CMAKE_BUILD_TYPE and CUDA_SDK_ROOT_DIR

[jamesdalg]

I am attempting to install openmm-tensorflow and am getting a prompt in ccmake about the build type and the CUDA_SDK_ROOT_DIR.

                                                     Page 1 of 1
 **CMAKE_BUILD_TYPE**                *
 CMAKE_INSTALL_PREFIX             /usr/local/openmm
 CUDA_HOST_COMPILER               /usr/bin/cc
 **CUDA_SDK_ROOT_DIR**                CUDA_SDK_ROOT_DIR-NOTFOUND
 CUDA_TOOLKIT_ROOT_DIR            /usr/local/cuda-12.2
 CUDA_USE_STATIC_CUDA_RUNTIME     ON
 CUDA_rt_LIBRARY                  /usr/lib/x86_64-linux-gnu/librt.a
 NN_BUILD_CUDA_LIB                ON
 NN_BUILD_OPENCL_LIB              ON
 NN_BUILD_PYTHON_WRAPPERS         ON
 OPENCL_INCLUDE_DIR               /usr/include
 OPENCL_LIBRARY                   /usr/lib/x86_64-linux-gnu/libOpenCL.so
 OPENMM_DIR                       /usr/local/openmm
 PYTHON_EXECUTABLE                /home/jd/mambaforge/envs/openmmtensorflow/bin/python
 SWIG_EXECUTABLE                  /usr/bin/swig
 TENSORFLOW_DIR                   /usr/local

I have configured my environment as the following:

(openmmtensorflow) jd@oban:/code/openmm/openmm_plugins/openmm-tensorflow/build$ conda env export
name: openmmtensorflow
channels:
  - nvidia  - conda-forge
  - omnia
  - bioconda
  - defaults
  - anaconda
  - hcc
dependencies:
  - _libgcc_mutex=0.1=conda_forge
  - _openmp_mutex=4.5=2_gnu
  - absl-py=2.0.0=pyhd8ed1ab_0
  - aiohttp=3.9.1=py311h459d7ec_0
  - aiosignal=1.3.1=pyhd8ed1ab_0
  - astunparse=1.6.3=pyhd8ed1ab_0
  - attrs=23.2.0=pyh71513ae_0
  - blinker=1.7.0=pyhd8ed1ab_0
  - brotli-python=1.1.0=py311hb755f60_1
  - bzip2=1.0.8=hd590300_5
  - c-ares=1.25.0=hd590300_0
  - ca-certificates=2023.11.17=hbcca054_0
  - cached-property=1.5.2=hd8ed1ab_1
  - cached_property=1.5.2=pyha770c72_1
  - cachetools=5.3.2=pyhd8ed1ab_0
  - certifi=2023.11.17=pyhd8ed1ab_0
  - cffi=1.16.0=py311hb3a22ac_0
  - charset-normalizer=3.3.2=pyhd8ed1ab_0
  - click=8.1.7=unix_pyh707e725_0
  - cryptography=41.0.7=py311hcb13ee4_1
  - cuda-version=11.7=h67201e3_2
  - cudatoolkit=11.7.0=hd8887f6_10
  - cudnn=8.8.0.121=hcdd5f01_4
  - flatbuffers=23.5.26=h59595ed_1
  - frozenlist=1.4.1=py311h459d7ec_0
  - gast=0.5.4=pyhd8ed1ab_0
  - giflib=5.2.1=h0b41bf4_3
  - google-auth=2.26.1=pyhca7485f_0
  - google-auth-oauthlib=1.0.0=pyhd8ed1ab_1
  - google-pasta=0.2.0=pyh8c360ce_0
  - grpcio=1.54.3=py311hcafe171_0
  - h5py=3.10.0=nompi_py311hebc2b07_101
  - hdf5=1.14.3=nompi_h4f84152_100
  - icu=73.2=h59595ed_0
  - idna=3.6=pyhd8ed1ab_0
  - importlib-metadata=7.0.1=pyha770c72_0
  - keras=2.13.1=pyhd8ed1ab_0
  - keyutils=1.6.1=h166bdaf_0
  - krb5=1.21.2=h659d440_0
  - ld_impl_linux-64=2.40=h41732ed_0
  - libabseil=20230125.3=cxx17_h59595ed_0
  - libaec=1.1.2=h59595ed_1
  - libblas=3.9.0=20_linux64_openblas
  - libcblas=3.9.0=20_linux64_openblas
  - libcurl=8.5.0=hca28451_0
  - libedit=3.1.20191231=he28a2e2_2
  - libev=4.33=hd590300_2
  - libexpat=2.5.0=hcb278e6_1
  - libffi=3.4.2=h7f98852_5
  - libgcc-ng=13.2.0=h807b86a_3
  - libgfortran-ng=13.2.0=h69a702a_3
  - libgfortran5=13.2.0=ha4646dd_3
  - libgomp=13.2.0=h807b86a_3
  - libgrpc=1.54.3=hb20ce57_0
  - libjpeg-turbo=3.0.0=hd590300_1
  - liblapack=3.9.0=20_linux64_openblas
  - libnghttp2=1.58.0=h47da74e_1
  - libnsl=2.0.1=hd590300_0
  - libopenblas=0.3.25=pthreads_h413a1c8_0
  - libpng=1.6.39=h753d276_0
  - libprotobuf=3.21.12=hfc55251_2
  - libsqlite=3.44.2=h2797004_0
  - libssh2=1.11.0=h0841786_0
  - libstdcxx-ng=13.2.0=h7e041cc_3
  - libuuid=2.38.1=h0b41bf4_0
  - libxcrypt=4.4.36=hd590300_1
  - libzlib=1.2.13=hd590300_5
  - markdown=3.5.1=pyhd8ed1ab_0
  - markupsafe=2.1.3=py311h459d7ec_1
  - multidict=6.0.4=py311h459d7ec_1
  - nccl=2.19.4.1=h0800d71_0
  - ncurses=6.4=h59595ed_2
  - numpy=1.26.3=py311h64a7726_0
  - oauthlib=3.2.2=pyhd8ed1ab_0
  - ocl-icd=2.3.1=h7f98852_0
  - ocl-icd-system=1.0.0=1
  - openmm=8.1.0=py311h6f6ebe4_1
  - openssl=3.2.0=hd590300_1
  - opt_einsum=3.3.0=pyhc1e730c_2
  - packaging=23.2=pyhd8ed1ab_0
  - pip=23.3.2=pyhd8ed1ab_0
  - protobuf=4.21.12=py311hcafe171_0
  - pyasn1=0.5.1=pyhd8ed1ab_0
  - pyasn1-modules=0.3.0=pyhd8ed1ab_0
  - pycparser=2.21=pyhd8ed1ab_0
  - pyjwt=2.8.0=pyhd8ed1ab_0
  - pyopenssl=23.3.0=pyhd8ed1ab_0
  - pysocks=1.7.1=pyha2e5f31_6
  - python=3.11.7=hab00c5b_1_cpython
  - python-flatbuffers=23.5.26=pyhd8ed1ab_0
  - python_abi=3.11=4_cp311
  - pyu2f=0.1.5=pyhd8ed1ab_0
  - re2=2023.03.02=h8c504da_0
  - readline=8.2=h8228510_1
  - requests=2.31.0=pyhd8ed1ab_0
  - requests-oauthlib=1.3.1=pyhd8ed1ab_0
  - rsa=4.9=pyhd8ed1ab_0
  - scipy=1.11.4=py311h64a7726_0
  - setuptools=69.0.3=pyhd8ed1ab_0
  - six=1.16.0=pyh6c4a22f_0
  - snappy=1.1.10=h9fff704_0
  - tensorboard=2.13.0=pyhd8ed1ab_0
  - tensorboard-data-server=0.7.0=py311h63ff55d_1
  - tensorflow=2.13.1=cuda112py311h693fce6_1
  - tensorflow-base=2.13.1=cuda112py311h8bdbb6c_1
  - tensorflow-estimator=2.13.1=cuda112py311h0d913ca_1
  - termcolor=2.4.0=pyhd8ed1ab_0
  - tk=8.6.13=noxft_h4845f30_101
  - typing_extensions=4.5.0=pyha770c72_0
  - tzdata=2023d=h0c530f3_0
  - urllib3=2.1.0=pyhd8ed1ab_0
  - werkzeug=3.0.1=pyhd8ed1ab_0
  - wheel=0.42.0=pyhd8ed1ab_0
  - wrapt=1.16.0=py311h459d7ec_0
  - xz=5.2.6=h166bdaf_0
  - yarl=1.9.3=py311h459d7ec_0
  - zipp=3.17.0=pyhd8ed1ab_0
  - zlib=1.2.13=hd590300_5
  - zstd=1.5.5=hfc55251_0
prefix: /home/jd/mambaforge/envs/openmmtensorflow

What precisely needs to be set in these two fields?
CMAKE_BUILD_TYPE
CUDA_SDK_ROOT_DIR

To clarify, I have created a build dir in /code/openmm/openmm_plugins/openmm-tensorflow/build after just cloning the repository.

[jamesdalg]

Here is my current nvidia-smi output:

(openmmtensorflow) jd@oban:/code/openmm/openmm_plugins/openmm-tensorflow/build$ nvidia-smi
Wed Jan 10 13:54:09 2024       
+---------------------------------------------------------------------------------------+
| NVIDIA-SMI 535.104.05             Driver Version: 535.104.05   CUDA Version: 12.2     |
|-----------------------------------------+----------------------+----------------------+
| GPU  Name                 Persistence-M | Bus-Id        Disp.A | Volatile Uncorr. ECC |
| Fan  Temp   Perf          Pwr:Usage/Cap |         Memory-Usage | GPU-Util  Compute M. |
|                                         |                      |               MIG M. |
|=========================================+======================+======================|
|   0  NVIDIA RTX A5000               On  | 00000000:17:00.0 Off |                  Off |
| 30%   33C    P8              25W / 230W |    851MiB / 24564MiB |      0%      Default |
|                                         |                      |                  N/A |
+-----------------------------------------+----------------------+----------------------+
|   1  NVIDIA RTX A5000               On  | 00000000:73:00.0  On |                  Off |
| 30%   56C    P0              67W / 230W |   3753MiB / 24564MiB |     35%      Default |
|                                         |                      |                  N/A |
+-----------------------------------------+----------------------+----------------------+
                                                                                         
+---------------------------------------------------------------------------------------+
| Processes:                                                                            |
|  GPU   GI   CI        PID   Type   Process name                            GPU Memory |
|        ID   ID                                                             Usage      |
|=======================================================================================|
|    0   N/A  N/A      4358      G   /usr/lib/xorg/Xorg                            4MiB |
|    0   N/A  N/A     34246      C   ...s/ovito-pro-3.10.0-x86_64/bin/ovito      834MiB |
|    1   N/A  N/A      4358      G   /usr/lib/xorg/Xorg                         1521MiB |
|    1   N/A  N/A      4537      G   /usr/bin/gnome-shell                        287MiB |
|    1   N/A  N/A     34246      G   ...s/ovito-pro-3.10.0-x86_64/bin/ovito       56MiB |
|    1   N/A  N/A     94411      G   coolercontrol                               198MiB |
|    1   N/A  N/A     97986      G   ...irefox/3600/usr/lib/firefox/firefox      351MiB |
|    1   N/A  N/A    257098      G   ...sion,SpareRendererForSitePerProcess      331MiB |
|    1   N/A  N/A    257100      G   ...ures=SpareRendererForSitePerProcess      471MiB |
|    1   N/A  N/A    257286      G   ...7145292,18175410111797470196,262144      147MiB |
+---------------------------------------------------------------------------------------+

[peastman]

Set CMAKE_BUILD_TYPE to Release.

Set CUDA_SDK_ROOT_DIR to wherever the CUDA toolkit is installed. That's typically /usr/local/cuda or something similar.

Note that the cudatoolkit package installed by conda isn't really the full toolkit. It just contains the redistributable libraries needed at runtime. To compile programs that use CUDA, you need to get the full toolkit from NVIDIA.

[virtualmartire]

Hello,

Setting CMAKE_BUILD_TYPE=Release works for us (we are building without CUDA). "Configure" seems to works too, except this warning appears:

No project() command is present.  The top-level CMakeLists.txt file must
   contain a literal, direct call to the project() command.  Add a line of
   code such as

     project(ProjectName)

   near the top of the file, but after cmake_minimum_required().

   CMake is pretending there is a "project(Project)" command on the first
   line.

Also, "Generate" runs incredibly fast.

By the way, the installation doesn't end properly. On Mac we have this error:

[  4%] Building CXX object CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForce.cpp.o
clang: warning: argument unused during compilation: '-msse2' [-Wunused-command-line-argument]
In file included from /Users/lucio/code/openmm-tensorflow/openmmapi/src/NeuralNetworkForce.cpp:32:
/Users/lucio/code/openmm-tensorflow/openmmapi/include/NeuralNetworkForce.h:35:10: fatal error: 'openmm/Context.h' file not found
#include "openmm/Context.h"
         ^~~~~~~~~~~~~~~~~~
1 error generated.
make[2]: *** [CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForce.cpp.o] Error 1
make[1]: *** [CMakeFiles/OpenMMNN.dir/all] Error 2
make: *** [all] Error 2

while on Linux this one

[  7%] Building CXX object CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForce.cpp.o
In file included from /root/test/openmm-tensorflow/openmmapi/src/NeuralNetworkForce.cpp:33:
/root/test/openmm-tensorflow/openmmapi/include/internal/NeuralNetworkForceImpl.h:38:10: fatal error: c_api.h: No such file or directory
   38 | #include <c_api.h>
      |          ^~~~~~~~~
compilation terminated.
make[2]: *** [CMakeFiles/OpenMMNN.dir/build.make:76: CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForce.cpp.o] Error 1
make[1]: *** [CMakeFiles/Makefile2:137: CMakeFiles/OpenMMNN.dir/all] Error 2
make: *** [Makefile:146: all] Error 2

What is happening? Thank you!

Appendix

I also append the cmake files below for completeness.

CMakeCache.txt (Linux)

# This is the CMakeCache file.
# For build in directory: /root/test/openmm-tensorflow/build
# It was generated by CMake: /usr/bin/cmake
# You can edit this file to change values found and used by cmake.
# If you do not want to change any of the values, simply exit the editor.
# If you do want to change a value, simply edit, save, and exit the editor.
# The syntax for the file is as follows:
# KEY:TYPE=VALUE
# KEY is the name of a variable in the cache.
# TYPE is a hint to GUIs for the type of VALUE, DO NOT EDIT TYPE!.
# VALUE is the current value for the KEY.

########################
# EXTERNAL cache entries
########################

//Path to a program.
CMAKE_ADDR2LINE:FILEPATH=/usr/bin/addr2line

//Path to a program.
CMAKE_AR:FILEPATH=/usr/bin/ar

//Choose the type of build.  Options include: empty, Debug, Release,
// RelWithDebInfo, MinSizeRel.
CMAKE_BUILD_TYPE:STRING=Release

//Enable/Disable color output during build.
CMAKE_COLOR_MAKEFILE:BOOL=ON

//CXX compiler
CMAKE_CXX_COMPILER:FILEPATH=/usr/bin/c++

//A wrapper around 'ar' adding the appropriate '--plugin' option
// for the GCC compiler
CMAKE_CXX_COMPILER_AR:FILEPATH=/usr/bin/gcc-ar-12

//A wrapper around 'ranlib' adding the appropriate '--plugin' option
// for the GCC compiler
CMAKE_CXX_COMPILER_RANLIB:FILEPATH=/usr/bin/gcc-ranlib-12

//Flags used by the CXX compiler during all build types.
CMAKE_CXX_FLAGS:STRING=

//Flags used by the CXX compiler during DEBUG builds.
CMAKE_CXX_FLAGS_DEBUG:STRING=-g

//Flags used by the CXX compiler during MINSIZEREL builds.
CMAKE_CXX_FLAGS_MINSIZEREL:STRING=-Os -DNDEBUG

//Flags used by the CXX compiler during RELEASE builds.
CMAKE_CXX_FLAGS_RELEASE:STRING=-O3 -DNDEBUG

//Flags used by the CXX compiler during RELWITHDEBINFO builds.
CMAKE_CXX_FLAGS_RELWITHDEBINFO:STRING=-O2 -g -DNDEBUG

//C compiler
CMAKE_C_COMPILER:FILEPATH=/usr/bin/cc

//A wrapper around 'ar' adding the appropriate '--plugin' option
// for the GCC compiler
CMAKE_C_COMPILER_AR:FILEPATH=/usr/bin/gcc-ar-12

//A wrapper around 'ranlib' adding the appropriate '--plugin' option
// for the GCC compiler
CMAKE_C_COMPILER_RANLIB:FILEPATH=/usr/bin/gcc-ranlib-12

//Flags used by the C compiler during all build types.
CMAKE_C_FLAGS:STRING=

//Flags used by the C compiler during DEBUG builds.
CMAKE_C_FLAGS_DEBUG:STRING=-g

//Flags used by the C compiler during MINSIZEREL builds.
CMAKE_C_FLAGS_MINSIZEREL:STRING=-Os -DNDEBUG

//Flags used by the C compiler during RELEASE builds.
CMAKE_C_FLAGS_RELEASE:STRING=-O3 -DNDEBUG

//Flags used by the C compiler during RELWITHDEBINFO builds.
CMAKE_C_FLAGS_RELWITHDEBINFO:STRING=-O2 -g -DNDEBUG

//Path to a program.
CMAKE_DLLTOOL:FILEPATH=CMAKE_DLLTOOL-NOTFOUND

//Flags used by the linker during all build types.
CMAKE_EXE_LINKER_FLAGS:STRING=

//Flags used by the linker during DEBUG builds.
CMAKE_EXE_LINKER_FLAGS_DEBUG:STRING=

//Flags used by the linker during MINSIZEREL builds.
CMAKE_EXE_LINKER_FLAGS_MINSIZEREL:STRING=

//Flags used by the linker during RELEASE builds.
CMAKE_EXE_LINKER_FLAGS_RELEASE:STRING=

//Flags used by the linker during RELWITHDEBINFO builds.
CMAKE_EXE_LINKER_FLAGS_RELWITHDEBINFO:STRING=

//Enable/Disable output of compile commands during generation.
CMAKE_EXPORT_COMPILE_COMMANDS:BOOL=

//Value Computed by CMake.
CMAKE_FIND_PACKAGE_REDIRECTS_DIR:STATIC=/root/test/openmm-tensorflow/build/CMakeFiles/pkgRedirects

//Where to install the plugin
CMAKE_INSTALL_PREFIX:PATH=/usr/local/openmm

//Path to a program.
CMAKE_LINKER:FILEPATH=/usr/bin/ld

//Path to a program.
CMAKE_MAKE_PROGRAM:FILEPATH=/usr/bin/gmake

//Flags used by the linker during the creation of modules during
// all build types.
CMAKE_MODULE_LINKER_FLAGS:STRING=

//Flags used by the linker during the creation of modules during
// DEBUG builds.
CMAKE_MODULE_LINKER_FLAGS_DEBUG:STRING=

//Flags used by the linker during the creation of modules during
// MINSIZEREL builds.
CMAKE_MODULE_LINKER_FLAGS_MINSIZEREL:STRING=

//Flags used by the linker during the creation of modules during
// RELEASE builds.
CMAKE_MODULE_LINKER_FLAGS_RELEASE:STRING=

Luciano Colosio, [15/04/24 17:58]
//Flags used by the linker during the creation of modules during
// RELWITHDEBINFO builds.
CMAKE_MODULE_LINKER_FLAGS_RELWITHDEBINFO:STRING=

//Path to a program.
CMAKE_NM:FILEPATH=/usr/bin/nm

//Path to a program.
CMAKE_OBJCOPY:FILEPATH=/usr/bin/objcopy

//Path to a program.
CMAKE_OBJDUMP:FILEPATH=/usr/bin/objdump

//Value Computed by CMake
CMAKE_PROJECT_DESCRIPTION:STATIC=

//Value Computed by CMake
CMAKE_PROJECT_HOMEPAGE_URL:STATIC=

//Value Computed by CMake
CMAKE_PROJECT_NAME:STATIC=Project

//Path to a program.
CMAKE_RANLIB:FILEPATH=/usr/bin/ranlib

//Path to a program.
CMAKE_READELF:FILEPATH=/usr/bin/readelf

//Flags used by the linker during the creation of shared libraries
// during all build types.
CMAKE_SHARED_LINKER_FLAGS:STRING=

//Flags used by the linker during the creation of shared libraries
// during DEBUG builds.
CMAKE_SHARED_LINKER_FLAGS_DEBUG:STRING=

//Flags used by the linker during the creation of shared libraries
// during MINSIZEREL builds.
CMAKE_SHARED_LINKER_FLAGS_MINSIZEREL:STRING=

//Flags used by the linker during the creation of shared libraries
// during RELEASE builds.
CMAKE_SHARED_LINKER_FLAGS_RELEASE:STRING=

//Flags used by the linker during the creation of shared libraries
// during RELWITHDEBINFO builds.
CMAKE_SHARED_LINKER_FLAGS_RELWITHDEBINFO:STRING=

//If set, runtime paths are not added when installing shared libraries,
// but are added when building.
CMAKE_SKIP_INSTALL_RPATH:BOOL=NO

//If set, runtime paths are not added when using shared libraries.
CMAKE_SKIP_RPATH:BOOL=NO

//Flags used by the linker during the creation of static libraries
// during all build types.
CMAKE_STATIC_LINKER_FLAGS:STRING=

//Flags used by the linker during the creation of static libraries
// during DEBUG builds.
CMAKE_STATIC_LINKER_FLAGS_DEBUG:STRING=

//Flags used by the linker during the creation of static libraries
// during MINSIZEREL builds.
CMAKE_STATIC_LINKER_FLAGS_MINSIZEREL:STRING=

//Flags used by the linker during the creation of static libraries
// during RELEASE builds.
CMAKE_STATIC_LINKER_FLAGS_RELEASE:STRING=

//Flags used by the linker during the creation of static libraries
// during RELWITHDEBINFO builds.
CMAKE_STATIC_LINKER_FLAGS_RELWITHDEBINFO:STRING=

//Path to a program.
CMAKE_STRIP:FILEPATH=/usr/bin/strip

//If this value is on, makefiles will be generated without the
// .SILENT directive, and all commands will be echoed to the console
// during the make.  This is useful for debugging only. With Visual
// Studio IDE projects all commands are done without /nologo.
CMAKE_VERBOSE_MAKEFILE:BOOL=FALSE

//Compile device code in 64 bit mode
CUDA_64_BIT_DEVICE_CODE:BOOL=ON

//Attach the build rule to the CUDA source file.  Enable only when
// the CUDA source file is added to at most one target.
CUDA_ATTACH_VS_BUILD_RULE_TO_CUDA_FILE:BOOL=ON

//Generate and parse .cubin files in Device mode.
CUDA_BUILD_CUBIN:BOOL=OFF

//Build in Emulation mode
CUDA_BUILD_EMULATION:BOOL=OFF

//"cudart" library
CUDA_CUDART_LIBRARY:FILEPATH=CUDA_CUDART_LIBRARY-NOTFOUND

//"cuda" library (older versions only).
CUDA_CUDA_LIBRARY:FILEPATH=CUDA_CUDA_LIBRARY-NOTFOUND

//Directory to put all the output files.  If blank it will default
// to the CMAKE_CURRENT_BINARY_DIR
CUDA_GENERATED_OUTPUT_DIR:PATH=

//Generated file extension
CUDA_HOST_COMPILATION_CPP:BOOL=ON

//Host side compiler used by NVCC
CUDA_HOST_COMPILER:FILEPATH=/usr/bin/cc

//Path to a program.
CUDA_NVCC_EXECUTABLE:FILEPATH=CUDA_NVCC_EXECUTABLE-NOTFOUND

//Semi-colon delimit multiple arguments. during all build types.
CUDA_NVCC_FLAGS:STRING=

//Semi-colon delimit multiple arguments. during DEBUG builds.
CUDA_NVCC_FLAGS_DEBUG:STRING=

//Semi-colon delimit multiple arguments. during MINSIZEREL builds.
CUDA_NVCC_FLAGS_MINSIZEREL:STRING=

//Semi-colon delimit multiple arguments. during RELEASE builds.
CUDA_NVCC_FLAGS_RELEASE:STRING=

//Semi-colon delimit multiple arguments. during RELWITHDEBINFO
// builds.
CUDA_NVCC_FLAGS_RELWITHDEBINFO:STRING=

//Propagate C/CXX_FLAGS and friends to the host compiler via -Xcompile
CUDA_PROPAGATE_HOST_FLAGS:BOOL=ON

Luciano Colosio, [15/04/24 17:58]
//Path to a file.
CUDA_SDK_ROOT_DIR:PATH=CUDA_SDK_ROOT_DIR-NOTFOUND

//Compile CUDA objects with separable compilation enabled.  Requires
// CUDA 5.0+
CUDA_SEPARABLE_COMPILATION:BOOL=OFF

//Path to a file.
CUDA_TOOLKIT_INCLUDE:PATH=CUDA_TOOLKIT_INCLUDE-NOTFOUND

//Print out the commands run while compiling the CUDA source file.
//  With the Makefile generator this defaults to VERBOSE variable
// specified on the command line, but can be forced on with this
// option.
CUDA_VERBOSE_BUILD:BOOL=OFF

//"cublas" library
CUDA_cublas_LIBRARY:FILEPATH=CUDA_cublas_LIBRARY-NOTFOUND

//"cublasemu" library
CUDA_cublasemu_LIBRARY:FILEPATH=CUDA_cublasemu_LIBRARY-NOTFOUND

//"cufft" library
CUDA_cufft_LIBRARY:FILEPATH=CUDA_cufft_LIBRARY-NOTFOUND

//"cufftemu" library
CUDA_cufftemu_LIBRARY:FILEPATH=CUDA_cufftemu_LIBRARY-NOTFOUND

//Build implementation for CUDA
NN_BUILD_CUDA_LIB:BOOL=OFF

//Build implementation for OpenCL
NN_BUILD_OPENCL_LIB:BOOL=OFF

//Build wrappers for Python
NN_BUILD_PYTHON_WRAPPERS:BOOL=ON

//Path to a file.
OPENCL_INCLUDE_DIR:PATH=OPENCL_INCLUDE_DIR-NOTFOUND

//Path to a library.
OPENCL_LIBRARY:FILEPATH=OPENCL_LIBRARY-NOTFOUND

//Where OpenMM is installed
OPENMM_DIR:PATH=/usr/local/openmm

//Dependencies for the target
OpenMMNNReference_LIB_DEPENDS:STATIC=general;OpenMM;debug;OpenMMNN;optimized;OpenMMNN;

//Dependencies for the target
OpenMMNN_LIB_DEPENDS:STATIC=general;OpenMM;general;tensorflow;

//Path to a program.
PYTHON_EXECUTABLE:FILEPATH=/usr/bin/python

//Value Computed by CMake
Project_BINARY_DIR:STATIC=/root/test/openmm-tensorflow/build

//Value Computed by CMake
Project_IS_TOP_LEVEL:STATIC=ON

//Value Computed by CMake
Project_SOURCE_DIR:STATIC=/root/test/openmm-tensorflow

//Path to a program.
SWIG_EXECUTABLE:FILEPATH=/usr/bin/swig

//Where TensorFlow is installed
TENSORFLOW_DIR:PATH=/usr/local


########################
# INTERNAL cache entries
########################

Luciano Colosio, [15/04/24 17:58]
//ADVANCED property for variable: CMAKE_ADDR2LINE
CMAKE_ADDR2LINE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_AR
CMAKE_AR-ADVANCED:INTERNAL=1
//This is the directory where this CMakeCache.txt was created
CMAKE_CACHEFILE_DIR:INTERNAL=/root/test/openmm-tensorflow/build
//Major version of cmake used to create the current loaded cache
CMAKE_CACHE_MAJOR_VERSION:INTERNAL=3
//Minor version of cmake used to create the current loaded cache
CMAKE_CACHE_MINOR_VERSION:INTERNAL=24
//Patch version of cmake used to create the current loaded cache
CMAKE_CACHE_PATCH_VERSION:INTERNAL=2
//ADVANCED property for variable: CMAKE_COLOR_MAKEFILE
CMAKE_COLOR_MAKEFILE-ADVANCED:INTERNAL=1
//Path to CMake executable.
CMAKE_COMMAND:INTERNAL=/usr/bin/cmake
//Path to cpack program executable.
CMAKE_CPACK_COMMAND:INTERNAL=/usr/bin/cpack
//Path to ctest program executable.
CMAKE_CTEST_COMMAND:INTERNAL=/usr/bin/ctest
//ADVANCED property for variable: CMAKE_CXX_COMPILER
CMAKE_CXX_COMPILER-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_COMPILER_AR
CMAKE_CXX_COMPILER_AR-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_COMPILER_RANLIB
CMAKE_CXX_COMPILER_RANLIB-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_FLAGS
CMAKE_CXX_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_FLAGS_DEBUG
CMAKE_CXX_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_FLAGS_MINSIZEREL
CMAKE_CXX_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_FLAGS_RELEASE
CMAKE_CXX_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_FLAGS_RELWITHDEBINFO
CMAKE_CXX_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_COMPILER
CMAKE_C_COMPILER-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_COMPILER_AR
CMAKE_C_COMPILER_AR-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_COMPILER_RANLIB
CMAKE_C_COMPILER_RANLIB-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_FLAGS
CMAKE_C_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_FLAGS_DEBUG
CMAKE_C_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_FLAGS_MINSIZEREL
CMAKE_C_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_FLAGS_RELEASE
CMAKE_C_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_FLAGS_RELWITHDEBINFO
CMAKE_C_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_DLLTOOL
CMAKE_DLLTOOL-ADVANCED:INTERNAL=1
//Path to cache edit program executable.
CMAKE_EDIT_COMMAND:INTERNAL=/usr/bin/ccmake
//Executable file format
CMAKE_EXECUTABLE_FORMAT:INTERNAL=ELF
//ADVANCED property for variable: CMAKE_EXE_LINKER_FLAGS
CMAKE_EXE_LINKER_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_EXE_LINKER_FLAGS_DEBUG
CMAKE_EXE_LINKER_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_EXE_LINKER_FLAGS_MINSIZEREL
CMAKE_EXE_LINKER_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_EXE_LINKER_FLAGS_RELEASE
CMAKE_EXE_LINKER_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_EXE_LINKER_FLAGS_RELWITHDEBINFO
CMAKE_EXE_LINKER_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_EXPORT_COMPILE_COMMANDS
CMAKE_EXPORT_COMPILE_COMMANDS-ADVANCED:INTERNAL=1
//Name of external makefile project generator.
CMAKE_EXTRA_GENERATOR:INTERNAL=
//Name of generator.
CMAKE_GENERATOR:INTERNAL=Unix Makefiles
//Generator instance identifier.
CMAKE_GENERATOR_INSTANCE:INTERNAL=
//Name of generator platform.
CMAKE_GENERATOR_PLATFORM:INTERNAL=
//Name of generator toolset.
CMAKE_GENERATOR_TOOLSET:INTERNAL=
//Source directory with the top level CMakeLists.txt file for this
// project
CMAKE_HOME_DIRECTORY:INTERNAL=/root/test/openmm-tensorflow
//Install .so files without execute permission.
CMAKE_INSTALL_SO_NO_EXE:INTERNAL=1
//ADVANCED property for variable: CMAKE_LINKER
CMAKE_LINKER-ADVANCED:INTERNAL=1

Luciano Colosio, [15/04/24 17:58]
//ADVANCED property for variable: CMAKE_MAKE_PROGRAM
CMAKE_MAKE_PROGRAM-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_MODULE_LINKER_FLAGS
CMAKE_MODULE_LINKER_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_MODULE_LINKER_FLAGS_DEBUG
CMAKE_MODULE_LINKER_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_MODULE_LINKER_FLAGS_MINSIZEREL
CMAKE_MODULE_LINKER_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_MODULE_LINKER_FLAGS_RELEASE
CMAKE_MODULE_LINKER_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_MODULE_LINKER_FLAGS_RELWITHDEBINFO
CMAKE_MODULE_LINKER_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_NM
CMAKE_NM-ADVANCED:INTERNAL=1
//number of local generators
CMAKE_NUMBER_OF_MAKEFILES:INTERNAL=5
//ADVANCED property for variable: CMAKE_OBJCOPY
CMAKE_OBJCOPY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_OBJDUMP
CMAKE_OBJDUMP-ADVANCED:INTERNAL=1
//Platform information initialized
CMAKE_PLATFORM_INFO_INITIALIZED:INTERNAL=1
//ADVANCED property for variable: CMAKE_RANLIB
CMAKE_RANLIB-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_READELF
CMAKE_READELF-ADVANCED:INTERNAL=1
//Path to CMake installation.
CMAKE_ROOT:INTERNAL=/usr/share/cmake-3.24
//ADVANCED property for variable: CMAKE_SHARED_LINKER_FLAGS
CMAKE_SHARED_LINKER_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SHARED_LINKER_FLAGS_DEBUG
CMAKE_SHARED_LINKER_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SHARED_LINKER_FLAGS_MINSIZEREL
CMAKE_SHARED_LINKER_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SHARED_LINKER_FLAGS_RELEASE
CMAKE_SHARED_LINKER_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SHARED_LINKER_FLAGS_RELWITHDEBINFO
CMAKE_SHARED_LINKER_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SKIP_INSTALL_RPATH
CMAKE_SKIP_INSTALL_RPATH-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SKIP_RPATH
CMAKE_SKIP_RPATH-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STATIC_LINKER_FLAGS
CMAKE_STATIC_LINKER_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STATIC_LINKER_FLAGS_DEBUG
CMAKE_STATIC_LINKER_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STATIC_LINKER_FLAGS_MINSIZEREL
CMAKE_STATIC_LINKER_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STATIC_LINKER_FLAGS_RELEASE
CMAKE_STATIC_LINKER_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STATIC_LINKER_FLAGS_RELWITHDEBINFO
CMAKE_STATIC_LINKER_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STRIP
CMAKE_STRIP-ADVANCED:INTERNAL=1
//uname command
CMAKE_UNAME:INTERNAL=/usr/bin/uname
//ADVANCED property for variable: CMAKE_VERBOSE_MAKEFILE
CMAKE_VERBOSE_MAKEFILE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_64_BIT_DEVICE_CODE
CUDA_64_BIT_DEVICE_CODE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_ATTACH_VS_BUILD_RULE_TO_CUDA_FILE
CUDA_ATTACH_VS_BUILD_RULE_TO_CUDA_FILE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_BUILD_CUBIN
CUDA_BUILD_CUBIN-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_BUILD_EMULATION
CUDA_BUILD_EMULATION-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_CUDART_LIBRARY
CUDA_CUDART_LIBRARY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_CUDA_LIBRARY
CUDA_CUDA_LIBRARY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_GENERATED_OUTPUT_DIR
CUDA_GENERATED_OUTPUT_DIR-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_HOST_COMPILATION_CPP
CUDA_HOST_COMPILATION_CPP-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_NVCC_EXECUTABLE
CUDA_NVCC_EXECUTABLE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_NVCC_FLAGS
CUDA_NVCC_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_NVCC_FLAGS_DEBUG
CUDA_NVCC_FLAGS_DEBUG-ADVANCED:INTERNAL=1

Luciano Colosio, [15/04/24 17:58]
//ADVANCED property for variable: CUDA_NVCC_FLAGS_MINSIZEREL
CUDA_NVCC_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_NVCC_FLAGS_RELEASE
CUDA_NVCC_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_NVCC_FLAGS_RELWITHDEBINFO
CUDA_NVCC_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_PROPAGATE_HOST_FLAGS
CUDA_PROPAGATE_HOST_FLAGS-ADVANCED:INTERNAL=1
//This is the value of the last time CUDA_SDK_ROOT_DIR was set
// successfully.
CUDA_SDK_ROOT_DIR_INTERNAL:INTERNAL=CUDA_SDK_ROOT_DIR-NOTFOUND
//ADVANCED property for variable: CUDA_SEPARABLE_COMPILATION
CUDA_SEPARABLE_COMPILATION-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_TOOLKIT_INCLUDE
CUDA_TOOLKIT_INCLUDE-ADVANCED:INTERNAL=1
//This is the value of the last time CUDA_TOOLKIT_ROOT_DIR was
// set successfully.
CUDA_TOOLKIT_ROOT_DIR_INTERNAL:INTERNAL=
//This is the value of the last time CUDA_TOOLKIT_TARGET_DIR was
// set successfully.
CUDA_TOOLKIT_TARGET_DIR_INTERNAL:INTERNAL=
CUDA_USE_STATIC_CUDA_RUNTIME:INTERNAL=OFF
//ADVANCED property for variable: CUDA_VERBOSE_BUILD
CUDA_VERBOSE_BUILD-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_cublas_LIBRARY
CUDA_cublas_LIBRARY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_cublasemu_LIBRARY
CUDA_cublasemu_LIBRARY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_cufft_LIBRARY
CUDA_cufft_LIBRARY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_cufftemu_LIBRARY
CUDA_cufftemu_LIBRARY-ADVANCED:INTERNAL=1
//Location of make2cmake.cmake
CUDA_make2cmake:INTERNAL=/usr/share/cmake-3.24/Modules/FindCUDA/make2cmake.cmake
//Location of parse_cubin.cmake
CUDA_parse_cubin:INTERNAL=/usr/share/cmake-3.24/Modules/FindCUDA/parse_cubin.cmake
//Location of run_nvcc.cmake
CUDA_run_nvcc:INTERNAL=/usr/share/cmake-3.24/Modules/FindCUDA/run_nvcc.cmake
//Single output directory for building all executables.
EXECUTABLE_OUTPUT_PATH:INTERNAL=/root/test/openmm-tensorflow/build
//Single output directory for building all libraries.
LIBRARY_OUTPUT_PATH:INTERNAL=/root/test/openmm-tensorflow/build
//ADVANCED property for variable: OPENCL_INCLUDE_DIR
OPENCL_INCLUDE_DIR-ADVANCED:INTERNAL=1
//ADVANCED property for variable: OPENCL_LIBRARY
OPENCL_LIBRARY-ADVANCED:INTERNAL=1
//linker supports push/pop state
_CMAKE_LINKER_PUSHPOP_STATE_SUPPORTED:INTERNAL=TRUE

CMakeCache.txt (Mac)

# This is the CMakeCache file.
# For build in directory: /Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build
# It was generated by CMake: /opt/homebrew/Cellar/cmake/3.26.3/bin/cmake
# You can edit this file to change values found and used by cmake.
# If you do not want to change any of the values, simply exit the editor.
# If you do want to change a value, simply edit, save, and exit the editor.
# The syntax for the file is as follows:
# KEY:TYPE=VALUE
# KEY is the name of a variable in the cache.
# TYPE is a hint to GUIs for the type of VALUE, DO NOT EDIT TYPE!.
# VALUE is the current value for the KEY.

########################
# EXTERNAL cache entries
########################

//Path to a program.
CMAKE_ADDR2LINE:FILEPATH=CMAKE_ADDR2LINE-NOTFOUND

//Path to a program.
CMAKE_AR:FILEPATH=/Applications/Xcode.app/Contents/Developer/Toolchains/XcodeDefault.xctoolchain/usr/bin/ar

//Choose the type of build, options are: None Debug Release RelWithDebInfo
// MinSizeRel ...
CMAKE_BUILD_TYPE:STRING=Release

//Enable/Disable color output during build.
CMAKE_COLOR_MAKEFILE:BOOL=ON

//CXX compiler
CMAKE_CXX_COMPILER:FILEPATH=/Applications/Xcode.app/Contents/Developer/Toolchains/XcodeDefault.xctoolchain/usr/bin/c++

//Flags used by the CXX compiler during all build types.
CMAKE_CXX_FLAGS:STRING=

//Flags used by the CXX compiler during DEBUG builds.
CMAKE_CXX_FLAGS_DEBUG:STRING=-g

//Flags used by the CXX compiler during MINSIZEREL builds.
CMAKE_CXX_FLAGS_MINSIZEREL:STRING=-Os -DNDEBUG

//Flags used by the CXX compiler during RELEASE builds.
CMAKE_CXX_FLAGS_RELEASE:STRING=-O3 -DNDEBUG

//Flags used by the CXX compiler during RELWITHDEBINFO builds.
CMAKE_CXX_FLAGS_RELWITHDEBINFO:STRING=-O2 -g -DNDEBUG

//C compiler
CMAKE_C_COMPILER:FILEPATH=/Applications/Xcode.app/Contents/Developer/Toolchains/XcodeDefault.xctoolchain/usr/bin/cc

//Flags used by the C compiler during all build types.
CMAKE_C_FLAGS:STRING=

//Flags used by the C compiler during DEBUG builds.
CMAKE_C_FLAGS_DEBUG:STRING=-g

//Flags used by the C compiler during MINSIZEREL builds.
CMAKE_C_FLAGS_MINSIZEREL:STRING=-Os -DNDEBUG

//Flags used by the C compiler during RELEASE builds.
CMAKE_C_FLAGS_RELEASE:STRING=-O3 -DNDEBUG

//Flags used by the C compiler during RELWITHDEBINFO builds.
CMAKE_C_FLAGS_RELWITHDEBINFO:STRING=-O2 -g -DNDEBUG

//Path to a program.
CMAKE_DLLTOOL:FILEPATH=CMAKE_DLLTOOL-NOTFOUND

//Flags used by the linker during all build types.
CMAKE_EXE_LINKER_FLAGS:STRING=

//Flags used by the linker during DEBUG builds.
CMAKE_EXE_LINKER_FLAGS_DEBUG:STRING=

//Flags used by the linker during MINSIZEREL builds.
CMAKE_EXE_LINKER_FLAGS_MINSIZEREL:STRING=

//Flags used by the linker during RELEASE builds.
CMAKE_EXE_LINKER_FLAGS_RELEASE:STRING=

//Flags used by the linker during RELWITHDEBINFO builds.
CMAKE_EXE_LINKER_FLAGS_RELWITHDEBINFO:STRING=

//Enable/Disable output of compile commands during generation.
CMAKE_EXPORT_COMPILE_COMMANDS:BOOL=

//Value Computed by CMake.
CMAKE_FIND_PACKAGE_REDIRECTS_DIR:STATIC=/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build/CMakeFiles/pkgRedirects

//Path to a program.
CMAKE_INSTALL_NAME_TOOL:FILEPATH=/usr/bin/install_name_tool

//Where to install the plugin
CMAKE_INSTALL_PREFIX:PATH=/usr/local/openmm

//Path to a program.
CMAKE_LINKER:FILEPATH=/Applications/Xcode.app/Contents/Developer/Toolchains/XcodeDefault.xctoolchain/usr/bin/ld

//Path to a program.
CMAKE_MAKE_PROGRAM:FILEPATH=/usr/bin/make

//Flags used by the linker during the creation of modules during
// all build types.
CMAKE_MODULE_LINKER_FLAGS:STRING=

//Flags used by the linker during the creation of modules during
// DEBUG builds.
CMAKE_MODULE_LINKER_FLAGS_DEBUG:STRING=

//Flags used by the linker during the creation of modules during
// MINSIZEREL builds.
CMAKE_MODULE_LINKER_FLAGS_MINSIZEREL:STRING=

//Flags used by the linker during the creation of modules during
// RELEASE builds.
CMAKE_MODULE_LINKER_FLAGS_RELEASE:STRING=

//Flags used by the linker during the creation of modules during
// RELWITHDEBINFO builds.
CMAKE_MODULE_LINKER_FLAGS_RELWITHDEBINFO:STRING=

//Path to a program.
CMAKE_NM:FILEPATH=/Applications/Xcode.app/Contents/Developer/Toolchains/XcodeDefault.xctoolchain/usr/bin/nm

//Path to a program.
CMAKE_OBJCOPY:FILEPATH=CMAKE_OBJCOPY-NOTFOUND

//Path to a program.
CMAKE_OBJDUMP:FILEPATH=/Applications/Xcode.app/Contents/Developer/Toolchains/XcodeDefault.xctoolchain/usr/bin/objdump

//Build architectures for OSX
CMAKE_OSX_ARCHITECTURES:STRING=

//Minimum OS X version to target for deployment (at runtime); newer
// APIs weak linked. Set to empty string for default value.
CMAKE_OSX_DEPLOYMENT_TARGET:STRING=

//The product will be built against the headers and libraries located
// inside the indicated SDK.
CMAKE_OSX_SYSROOT:PATH=/Applications/Xcode.app/Contents/Developer/Platforms/MacOSX.platform/Developer/SDKs/MacOSX14.4.sdk

//Value Computed by CMake
CMAKE_PROJECT_DESCRIPTION:STATIC=

//Value Computed by CMake
CMAKE_PROJECT_HOMEPAGE_URL:STATIC=

//Value Computed by CMake
CMAKE_PROJECT_NAME:STATIC=Project

//Path to a program.
CMAKE_RANLIB:FILEPATH=/Applications/Xcode.app/Contents/Developer/Toolchains/XcodeDefault.xctoolchain/usr/bin/ranlib

//Path to a program.
CMAKE_READELF:FILEPATH=CMAKE_READELF-NOTFOUND

//Flags used by the linker during the creation of shared libraries
// during all build types.
CMAKE_SHARED_LINKER_FLAGS:STRING=

//Flags used by the linker during the creation of shared libraries
// during DEBUG builds.
CMAKE_SHARED_LINKER_FLAGS_DEBUG:STRING=

//Flags used by the linker during the creation of shared libraries
// during MINSIZEREL builds.
CMAKE_SHARED_LINKER_FLAGS_MINSIZEREL:STRING=

//Flags used by the linker during the creation of shared libraries
// during RELEASE builds.
CMAKE_SHARED_LINKER_FLAGS_RELEASE:STRING=

//Flags used by the linker during the creation of shared libraries
// during RELWITHDEBINFO builds.
CMAKE_SHARED_LINKER_FLAGS_RELWITHDEBINFO:STRING=

//If set, runtime paths are not added when installing shared libraries,
// but are added when building.
CMAKE_SKIP_INSTALL_RPATH:BOOL=NO

//If set, runtime paths are not added when using shared libraries.
CMAKE_SKIP_RPATH:BOOL=NO

//Flags used by the linker during the creation of static libraries
// during all build types.
CMAKE_STATIC_LINKER_FLAGS:STRING=

//Flags used by the linker during the creation of static libraries
// during DEBUG builds.
CMAKE_STATIC_LINKER_FLAGS_DEBUG:STRING=

//Flags used by the linker during the creation of static libraries
// during MINSIZEREL builds.
CMAKE_STATIC_LINKER_FLAGS_MINSIZEREL:STRING=

//Flags used by the linker during the creation of static libraries
// during RELEASE builds.
CMAKE_STATIC_LINKER_FLAGS_RELEASE:STRING=

//Flags used by the linker during the creation of static libraries
// during RELWITHDEBINFO builds.
CMAKE_STATIC_LINKER_FLAGS_RELWITHDEBINFO:STRING=

//Path to a program.
CMAKE_STRIP:FILEPATH=/Applications/Xcode.app/Contents/Developer/Toolchains/XcodeDefault.xctoolchain/usr/bin/strip

//If this value is on, makefiles will be generated without the
// .SILENT directive, and all commands will be echoed to the console
// during the make.  This is useful for debugging only. With Visual
// Studio IDE projects all commands are done without /nologo.
CMAKE_VERBOSE_MAKEFILE:BOOL=FALSE

//Compile device code in 64 bit mode
CUDA_64_BIT_DEVICE_CODE:BOOL=ON

//Attach the build rule to the CUDA source file.  Enable only when
// the CUDA source file is added to at most one target.
CUDA_ATTACH_VS_BUILD_RULE_TO_CUDA_FILE:BOOL=ON

//Generate and parse .cubin files in Device mode.
CUDA_BUILD_CUBIN:BOOL=OFF

//Build in Emulation mode
CUDA_BUILD_EMULATION:BOOL=OFF

//"cudart" library
CUDA_CUDART_LIBRARY:FILEPATH=CUDA_CUDART_LIBRARY-NOTFOUND

//"cuda" library (older versions only).
CUDA_CUDA_LIBRARY:FILEPATH=CUDA_CUDA_LIBRARY-NOTFOUND

//Directory to put all the output files.  If blank it will default
// to the CMAKE_CURRENT_BINARY_DIR
CUDA_GENERATED_OUTPUT_DIR:PATH=

//Generated file extension
CUDA_HOST_COMPILATION_CPP:BOOL=ON

//Host side compiler used by NVCC
CUDA_HOST_COMPILER:FILEPATH=/Applications/Xcode.app/Contents/Developer/Toolchains/XcodeDefault.xctoolchain/usr/bin/clang

//Path to a program.
CUDA_NVCC_EXECUTABLE:FILEPATH=CUDA_NVCC_EXECUTABLE-NOTFOUND

//Semi-colon delimit multiple arguments. during all build types.
CUDA_NVCC_FLAGS:STRING=

//Semi-colon delimit multiple arguments. during DEBUG builds.
CUDA_NVCC_FLAGS_DEBUG:STRING=

//Semi-colon delimit multiple arguments. during MINSIZEREL builds.
CUDA_NVCC_FLAGS_MINSIZEREL:STRING=

//Semi-colon delimit multiple arguments. during RELEASE builds.
CUDA_NVCC_FLAGS_RELEASE:STRING=

//Semi-colon delimit multiple arguments. during RELWITHDEBINFO
// builds.
CUDA_NVCC_FLAGS_RELWITHDEBINFO:STRING=

//Propagate C/CXX_FLAGS and friends to the host compiler via -Xcompile
CUDA_PROPAGATE_HOST_FLAGS:BOOL=ON

//Path to a file.
CUDA_SDK_ROOT_DIR:PATH=CUDA_SDK_ROOT_DIR-NOTFOUND

//Compile CUDA objects with separable compilation enabled.  Requires
// CUDA 5.0+
CUDA_SEPARABLE_COMPILATION:BOOL=OFF

//Path to a file.
CUDA_TOOLKIT_INCLUDE:PATH=CUDA_TOOLKIT_INCLUDE-NOTFOUND

//Print out the commands run while compiling the CUDA source file.
//  With the Makefile generator this defaults to VERBOSE variable
// specified on the command line, but can be forced on with this
// option.
CUDA_VERBOSE_BUILD:BOOL=OFF

//"cublas" library
CUDA_cublas_LIBRARY:FILEPATH=CUDA_cublas_LIBRARY-NOTFOUND

//"cublasemu" library
CUDA_cublasemu_LIBRARY:FILEPATH=CUDA_cublasemu_LIBRARY-NOTFOUND

//"cufft" library
CUDA_cufft_LIBRARY:FILEPATH=CUDA_cufft_LIBRARY-NOTFOUND

//"cufftemu" library
CUDA_cufftemu_LIBRARY:FILEPATH=CUDA_cufftemu_LIBRARY-NOTFOUND

//Build implementation for CUDA
NN_BUILD_CUDA_LIB:BOOL=OFF

//Build implementation for OpenCL
NN_BUILD_OPENCL_LIB:BOOL=ON

//Build wrappers for Python
NN_BUILD_PYTHON_WRAPPERS:BOOL=OFF

//Path to a file.
OPENCL_INCLUDE_DIR:PATH=/Applications/Xcode.app/Contents/Developer/Platforms/MacOSX.platform/Developer/SDKs/MacOSX14.4.sdk/System/Library/Frameworks/OpenCL.framework/Headers

//Path to a library.
OPENCL_LIBRARY:FILEPATH=/Applications/Xcode.app/Contents/Developer/Platforms/MacOSX.platform/Developer/SDKs/MacOSX14.4.sdk/System/Library/Frameworks/OpenCL.framework

//Where OpenMM is installed
OPENMM_DIR:PATH=/usr/local/openmm

//Dependencies for the target
OpenMMNNOpenCL_LIB_DEPENDS:STATIC=general;/Applications/Xcode.app/Contents/Developer/Platforms/MacOSX.platform/Developer/SDKs/MacOSX14.4.sdk/System/Library/Frameworks/OpenCL.framework;general;OpenMM;general;OpenMMOpenCL;general;OpenMMNN;

//Dependencies for the target
OpenMMNNReference_LIB_DEPENDS:STATIC=general;OpenMM;debug;OpenMMNN;optimized;OpenMMNN;

//Dependencies for the target
OpenMMNN_LIB_DEPENDS:STATIC=general;OpenMM;general;tensorflow;

//Path to a program.
PYTHON_EXECUTABLE:FILEPATH=/Users/stefanomartire/miniforge3/envs/obiwan/bin/python

//Value Computed by CMake
Project_BINARY_DIR:STATIC=/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build

//Value Computed by CMake
Project_IS_TOP_LEVEL:STATIC=ON

//Value Computed by CMake
Project_SOURCE_DIR:STATIC=/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow

//Path to a program.
SWIG_EXECUTABLE:FILEPATH=SWIG_EXECUTABLE-NOTFOUND

//Where TensorFlow is installed
TENSORFLOW_DIR:PATH=/usr/local


########################
# INTERNAL cache entries
########################

//ADVANCED property for variable: CMAKE_ADDR2LINE
CMAKE_ADDR2LINE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_AR
CMAKE_AR-ADVANCED:INTERNAL=1
//MODIFIED property for variable: CMAKE_BUILD_TYPE
CMAKE_BUILD_TYPE-MODIFIED:INTERNAL=ON
//This is the directory where this CMakeCache.txt was created
CMAKE_CACHEFILE_DIR:INTERNAL=/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build
//Major version of cmake used to create the current loaded cache
CMAKE_CACHE_MAJOR_VERSION:INTERNAL=3
//Minor version of cmake used to create the current loaded cache
CMAKE_CACHE_MINOR_VERSION:INTERNAL=26
//Patch version of cmake used to create the current loaded cache
CMAKE_CACHE_PATCH_VERSION:INTERNAL=3
//ADVANCED property for variable: CMAKE_COLOR_MAKEFILE
CMAKE_COLOR_MAKEFILE-ADVANCED:INTERNAL=1
//Path to CMake executable.
CMAKE_COMMAND:INTERNAL=/opt/homebrew/Cellar/cmake/3.26.3/bin/cmake
//Path to cpack program executable.
CMAKE_CPACK_COMMAND:INTERNAL=/opt/homebrew/Cellar/cmake/3.26.3/bin/cpack
//Path to ctest program executable.
CMAKE_CTEST_COMMAND:INTERNAL=/opt/homebrew/Cellar/cmake/3.26.3/bin/ctest
//ADVANCED property for variable: CMAKE_CXX_COMPILER
CMAKE_CXX_COMPILER-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_FLAGS
CMAKE_CXX_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_FLAGS_DEBUG
CMAKE_CXX_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_FLAGS_MINSIZEREL
CMAKE_CXX_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_FLAGS_RELEASE
CMAKE_CXX_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_CXX_FLAGS_RELWITHDEBINFO
CMAKE_CXX_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_COMPILER
CMAKE_C_COMPILER-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_FLAGS
CMAKE_C_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_FLAGS_DEBUG
CMAKE_C_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_FLAGS_MINSIZEREL
CMAKE_C_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_FLAGS_RELEASE
CMAKE_C_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_C_FLAGS_RELWITHDEBINFO
CMAKE_C_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_DLLTOOL
CMAKE_DLLTOOL-ADVANCED:INTERNAL=1
//Path to cache edit program executable.
CMAKE_EDIT_COMMAND:INTERNAL=/opt/homebrew/Cellar/cmake/3.26.3/bin/ccmake
//Executable file format
CMAKE_EXECUTABLE_FORMAT:INTERNAL=MACHO
//ADVANCED property for variable: CMAKE_EXE_LINKER_FLAGS
CMAKE_EXE_LINKER_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_EXE_LINKER_FLAGS_DEBUG
CMAKE_EXE_LINKER_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_EXE_LINKER_FLAGS_MINSIZEREL
CMAKE_EXE_LINKER_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_EXE_LINKER_FLAGS_RELEASE
CMAKE_EXE_LINKER_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_EXE_LINKER_FLAGS_RELWITHDEBINFO
CMAKE_EXE_LINKER_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_EXPORT_COMPILE_COMMANDS
CMAKE_EXPORT_COMPILE_COMMANDS-ADVANCED:INTERNAL=1
//Name of external makefile project generator.
CMAKE_EXTRA_GENERATOR:INTERNAL=
//Name of generator.
CMAKE_GENERATOR:INTERNAL=Unix Makefiles
//Generator instance identifier.
CMAKE_GENERATOR_INSTANCE:INTERNAL=
//Name of generator platform.
CMAKE_GENERATOR_PLATFORM:INTERNAL=
//Name of generator toolset.
CMAKE_GENERATOR_TOOLSET:INTERNAL=
//Source directory with the top level CMakeLists.txt file for this
// project
CMAKE_HOME_DIRECTORY:INTERNAL=/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow
//ADVANCED property for variable: CMAKE_INSTALL_NAME_TOOL
CMAKE_INSTALL_NAME_TOOL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_LINKER
CMAKE_LINKER-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_MAKE_PROGRAM
CMAKE_MAKE_PROGRAM-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_MODULE_LINKER_FLAGS
CMAKE_MODULE_LINKER_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_MODULE_LINKER_FLAGS_DEBUG
CMAKE_MODULE_LINKER_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_MODULE_LINKER_FLAGS_MINSIZEREL
CMAKE_MODULE_LINKER_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_MODULE_LINKER_FLAGS_RELEASE
CMAKE_MODULE_LINKER_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_MODULE_LINKER_FLAGS_RELWITHDEBINFO
CMAKE_MODULE_LINKER_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_NM
CMAKE_NM-ADVANCED:INTERNAL=1
//number of local generators
CMAKE_NUMBER_OF_MAKEFILES:INTERNAL=6
//ADVANCED property for variable: CMAKE_OBJCOPY
CMAKE_OBJCOPY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_OBJDUMP
CMAKE_OBJDUMP-ADVANCED:INTERNAL=1
//Platform information initialized
CMAKE_PLATFORM_INFO_INITIALIZED:INTERNAL=1
//ADVANCED property for variable: CMAKE_RANLIB
CMAKE_RANLIB-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_READELF
CMAKE_READELF-ADVANCED:INTERNAL=1
//Path to CMake installation.
CMAKE_ROOT:INTERNAL=/opt/homebrew/Cellar/cmake/3.26.3/share/cmake
//ADVANCED property for variable: CMAKE_SHARED_LINKER_FLAGS
CMAKE_SHARED_LINKER_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SHARED_LINKER_FLAGS_DEBUG
CMAKE_SHARED_LINKER_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SHARED_LINKER_FLAGS_MINSIZEREL
CMAKE_SHARED_LINKER_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SHARED_LINKER_FLAGS_RELEASE
CMAKE_SHARED_LINKER_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SHARED_LINKER_FLAGS_RELWITHDEBINFO
CMAKE_SHARED_LINKER_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SKIP_INSTALL_RPATH
CMAKE_SKIP_INSTALL_RPATH-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_SKIP_RPATH
CMAKE_SKIP_RPATH-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STATIC_LINKER_FLAGS
CMAKE_STATIC_LINKER_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STATIC_LINKER_FLAGS_DEBUG
CMAKE_STATIC_LINKER_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STATIC_LINKER_FLAGS_MINSIZEREL
CMAKE_STATIC_LINKER_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STATIC_LINKER_FLAGS_RELEASE
CMAKE_STATIC_LINKER_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STATIC_LINKER_FLAGS_RELWITHDEBINFO
CMAKE_STATIC_LINKER_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CMAKE_STRIP
CMAKE_STRIP-ADVANCED:INTERNAL=1
//uname command
CMAKE_UNAME:INTERNAL=/usr/bin/uname
//ADVANCED property for variable: CMAKE_VERBOSE_MAKEFILE
CMAKE_VERBOSE_MAKEFILE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_64_BIT_DEVICE_CODE
CUDA_64_BIT_DEVICE_CODE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_ATTACH_VS_BUILD_RULE_TO_CUDA_FILE
CUDA_ATTACH_VS_BUILD_RULE_TO_CUDA_FILE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_BUILD_CUBIN
CUDA_BUILD_CUBIN-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_BUILD_EMULATION
CUDA_BUILD_EMULATION-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_CUDART_LIBRARY
CUDA_CUDART_LIBRARY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_CUDA_LIBRARY
CUDA_CUDA_LIBRARY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_GENERATED_OUTPUT_DIR
CUDA_GENERATED_OUTPUT_DIR-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_HOST_COMPILATION_CPP
CUDA_HOST_COMPILATION_CPP-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_NVCC_EXECUTABLE
CUDA_NVCC_EXECUTABLE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_NVCC_FLAGS
CUDA_NVCC_FLAGS-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_NVCC_FLAGS_DEBUG
CUDA_NVCC_FLAGS_DEBUG-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_NVCC_FLAGS_MINSIZEREL
CUDA_NVCC_FLAGS_MINSIZEREL-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_NVCC_FLAGS_RELEASE
CUDA_NVCC_FLAGS_RELEASE-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_NVCC_FLAGS_RELWITHDEBINFO
CUDA_NVCC_FLAGS_RELWITHDEBINFO-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_PROPAGATE_HOST_FLAGS
CUDA_PROPAGATE_HOST_FLAGS-ADVANCED:INTERNAL=1
//This is the value of the last time CUDA_SDK_ROOT_DIR was set
// successfully.
CUDA_SDK_ROOT_DIR_INTERNAL:INTERNAL=CUDA_SDK_ROOT_DIR-NOTFOUND
//ADVANCED property for variable: CUDA_SEPARABLE_COMPILATION
CUDA_SEPARABLE_COMPILATION-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_TOOLKIT_INCLUDE
CUDA_TOOLKIT_INCLUDE-ADVANCED:INTERNAL=1
//This is the value of the last time CUDA_TOOLKIT_ROOT_DIR was
// set successfully.
CUDA_TOOLKIT_ROOT_DIR_INTERNAL:INTERNAL=
//This is the value of the last time CUDA_TOOLKIT_TARGET_DIR was
// set successfully.
CUDA_TOOLKIT_TARGET_DIR_INTERNAL:INTERNAL=
CUDA_USE_STATIC_CUDA_RUNTIME:INTERNAL=OFF
//ADVANCED property for variable: CUDA_VERBOSE_BUILD
CUDA_VERBOSE_BUILD-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_cublas_LIBRARY
CUDA_cublas_LIBRARY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_cublasemu_LIBRARY
CUDA_cublasemu_LIBRARY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_cufft_LIBRARY
CUDA_cufft_LIBRARY-ADVANCED:INTERNAL=1
//ADVANCED property for variable: CUDA_cufftemu_LIBRARY
CUDA_cufftemu_LIBRARY-ADVANCED:INTERNAL=1
//Location of make2cmake.cmake
CUDA_make2cmake:INTERNAL=/opt/homebrew/Cellar/cmake/3.26.3/share/cmake/Modules/FindCUDA/make2cmake.cmake
//Location of parse_cubin.cmake
CUDA_parse_cubin:INTERNAL=/opt/homebrew/Cellar/cmake/3.26.3/share/cmake/Modules/FindCUDA/parse_cubin.cmake
//Location of run_nvcc.cmake
CUDA_run_nvcc:INTERNAL=/opt/homebrew/Cellar/cmake/3.26.3/share/cmake/Modules/FindCUDA/run_nvcc.cmake
//Single output directory for building all executables.
EXECUTABLE_OUTPUT_PATH:INTERNAL=/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build
//Details about finding OPENCL
FIND_PACKAGE_MESSAGE_DETAILS_OPENCL:INTERNAL=[/Applications/Xcode.app/Contents/Developer/Platforms/MacOSX.platform/Developer/SDKs/MacOSX14.4.sdk/System/Library/Frameworks/OpenCL.framework][/Applications/Xcode.app/Contents/Developer/Platforms/MacOSX.platform/Developer/SDKs/MacOSX14.4.sdk/System/Library/Frameworks/OpenCL.framework/Headers][v()]
//Single output directory for building all libraries.
LIBRARY_OUTPUT_PATH:INTERNAL=/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build
//ADVANCED property for variable: OPENCL_INCLUDE_DIR
OPENCL_INCLUDE_DIR-ADVANCED:INTERNAL=0
//ADVANCED property for variable: OPENCL_LIBRARY
OPENCL_LIBRARY-ADVANCED:INTERNAL=0

cmake_install.cmake (Mac)

# Install script for directory: /Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow

# Set the install prefix
if(NOT DEFINED CMAKE_INSTALL_PREFIX)
  set(CMAKE_INSTALL_PREFIX "/usr/local/openmm")
endif()
string(REGEX REPLACE "/$" "" CMAKE_INSTALL_PREFIX "${CMAKE_INSTALL_PREFIX}")

# Set the install configuration name.
if(NOT DEFINED CMAKE_INSTALL_CONFIG_NAME)
  if(BUILD_TYPE)
    string(REGEX REPLACE "^[^A-Za-z0-9_]+" ""
           CMAKE_INSTALL_CONFIG_NAME "${BUILD_TYPE}")
  else()
    set(CMAKE_INSTALL_CONFIG_NAME "Release")
  endif()
  message(STATUS "Install configuration: \"${CMAKE_INSTALL_CONFIG_NAME}\"")
endif()

# Set the component getting installed.
if(NOT CMAKE_INSTALL_COMPONENT)
  if(COMPONENT)
    message(STATUS "Install component: \"${COMPONENT}\"")
    set(CMAKE_INSTALL_COMPONENT "${COMPONENT}")
  else()
    set(CMAKE_INSTALL_COMPONENT)
  endif()
endif()

# Is this installation the result of a crosscompile?
if(NOT DEFINED CMAKE_CROSSCOMPILING)
  set(CMAKE_CROSSCOMPILING "FALSE")
endif()

# Set default install directory permissions.
if(NOT DEFINED CMAKE_OBJDUMP)
  set(CMAKE_OBJDUMP "/Applications/Xcode.app/Contents/Developer/Toolchains/XcodeDefault.xctoolchain/usr/bin/objdump")
endif()

if(CMAKE_INSTALL_COMPONENT STREQUAL "Unspecified" OR NOT CMAKE_INSTALL_COMPONENT)
  file(INSTALL DESTINATION "${CMAKE_INSTALL_PREFIX}/include" TYPE FILE FILES
    "/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/openmmapi/include/NeuralNetworkForce.h"
    "/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/openmmapi/include/NeuralNetworkKernels.h"
    )
endif()

if(CMAKE_INSTALL_COMPONENT STREQUAL "Unspecified" OR NOT CMAKE_INSTALL_COMPONENT)
  file(INSTALL DESTINATION "${CMAKE_INSTALL_PREFIX}/include/internal" TYPE FILE FILES
    "/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/openmmapi/include/internal/NeuralNetworkForceImpl.h"
    "/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/openmmapi/include/internal/windowsExportNN.h"
    )
endif()

if(CMAKE_INSTALL_COMPONENT STREQUAL "Unspecified" OR NOT CMAKE_INSTALL_COMPONENT)
  file(INSTALL DESTINATION "${CMAKE_INSTALL_PREFIX}/lib" TYPE SHARED_LIBRARY FILES "/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build/libOpenMMNN.dylib")
  if(EXISTS "$ENV{DESTDIR}${CMAKE_INSTALL_PREFIX}/lib/libOpenMMNN.dylib" AND
     NOT IS_SYMLINK "$ENV{DESTDIR}${CMAKE_INSTALL_PREFIX}/lib/libOpenMMNN.dylib")
    execute_process(COMMAND /usr/bin/install_name_tool
      -delete_rpath "/usr/local/openmm/lib"
      -delete_rpath "/usr/local/openmm/lib/plugins"
      -delete_rpath "/usr/local/lib"
      "$ENV{DESTDIR}${CMAKE_INSTALL_PREFIX}/lib/libOpenMMNN.dylib")
    if(CMAKE_INSTALL_DO_STRIP)
      execute_process(COMMAND "/Applications/Xcode.app/Contents/Developer/Toolchains/XcodeDefault.xctoolchain/usr/bin/strip" -x "$ENV{DESTDIR}${CMAKE_INSTALL_PREFIX}/lib/libOpenMMNN.dylib")
    endif()
  endif()
endif()

if(NOT CMAKE_INSTALL_LOCAL_ONLY)
  # Include the install script for each subdirectory.
  include("/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build/serialization/tests/cmake_install.cmake")
  include("/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build/platforms/reference/cmake_install.cmake")
  include("/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build/platforms/opencl/cmake_install.cmake")

endif()

if(CMAKE_INSTALL_COMPONENT)
  set(CMAKE_INSTALL_MANIFEST "install_manifest_${CMAKE_INSTALL_COMPONENT}.txt")
else()
  set(CMAKE_INSTALL_MANIFEST "install_manifest.txt")
endif()

string(REPLACE ";" "\n" CMAKE_INSTALL_MANIFEST_CONTENT
       "${CMAKE_INSTALL_MANIFEST_FILES}")
file(WRITE "/Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build/${CMAKE_INSTALL_MANIFEST}"
     "${CMAKE_INSTALL_MANIFEST_CONTENT}")

Makefile (Mac)

# CMAKE generated file: DO NOT EDIT!
# Generated by "Unix Makefiles" Generator, CMake Version 3.26

# Default target executed when no arguments are given to make.
default_target: all
.PHONY : default_target

# Allow only one "make -f Makefile2" at a time, but pass parallelism.
.NOTPARALLEL:

#=============================================================================
# Special targets provided by cmake.

# Disable implicit rules so canonical targets will work.
.SUFFIXES:

# Disable VCS-based implicit rules.
% : %,v

# Disable VCS-based implicit rules.
% : RCS/%

# Disable VCS-based implicit rules.
% : RCS/%,v

# Disable VCS-based implicit rules.
% : SCCS/s.%

# Disable VCS-based implicit rules.
% : s.%

.SUFFIXES: .hpux_make_needs_suffix_list

# Command-line flag to silence nested $(MAKE).
$(VERBOSE)MAKESILENT = -s

#Suppress display of executed commands.
$(VERBOSE).SILENT:

# A target that is always out of date.
cmake_force:
.PHONY : cmake_force

#=============================================================================
# Set environment variables for the build.

# The shell in which to execute make rules.
SHELL = /bin/sh

# The CMake executable.
CMAKE_COMMAND = /opt/homebrew/Cellar/cmake/3.26.3/bin/cmake

# The command to remove a file.
RM = /opt/homebrew/Cellar/cmake/3.26.3/bin/cmake -E rm -f

# Escaping for special characters.
EQUALS = =

# The top-level source directory on which CMake was run.
CMAKE_SOURCE_DIR = /Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow

# The top-level build directory on which CMake was run.
CMAKE_BINARY_DIR = /Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build

#=============================================================================
# Targets provided globally by CMake.

# Special rule for the target test
test:
	@$(CMAKE_COMMAND) -E cmake_echo_color --switch=$(COLOR) --cyan "Running tests..."
	/opt/homebrew/Cellar/cmake/3.26.3/bin/ctest --force-new-ctest-process $(ARGS)
.PHONY : test

# Special rule for the target test
test/fast: test
.PHONY : test/fast

# Special rule for the target edit_cache
edit_cache:
	@$(CMAKE_COMMAND) -E cmake_echo_color --switch=$(COLOR) --cyan "Running CMake cache editor..."
	/opt/homebrew/Cellar/cmake/3.26.3/bin/ccmake -S$(CMAKE_SOURCE_DIR) -B$(CMAKE_BINARY_DIR)
.PHONY : edit_cache

# Special rule for the target edit_cache
edit_cache/fast: edit_cache
.PHONY : edit_cache/fast

# Special rule for the target rebuild_cache
rebuild_cache:
	@$(CMAKE_COMMAND) -E cmake_echo_color --switch=$(COLOR) --cyan "Running CMake to regenerate build system..."
	/opt/homebrew/Cellar/cmake/3.26.3/bin/cmake --regenerate-during-build -S$(CMAKE_SOURCE_DIR) -B$(CMAKE_BINARY_DIR)
.PHONY : rebuild_cache

# Special rule for the target rebuild_cache
rebuild_cache/fast: rebuild_cache
.PHONY : rebuild_cache/fast

# Special rule for the target list_install_components
list_install_components:
	@$(CMAKE_COMMAND) -E cmake_echo_color --switch=$(COLOR) --cyan "Available install components are: \"Unspecified\""
.PHONY : list_install_components

# Special rule for the target list_install_components
list_install_components/fast: list_install_components
.PHONY : list_install_components/fast

# Special rule for the target install
install: preinstall
	@$(CMAKE_COMMAND) -E cmake_echo_color --switch=$(COLOR) --cyan "Install the project..."
	/opt/homebrew/Cellar/cmake/3.26.3/bin/cmake -P cmake_install.cmake
.PHONY : install

# Special rule for the target install
install/fast: preinstall/fast
	@$(CMAKE_COMMAND) -E cmake_echo_color --switch=$(COLOR) --cyan "Install the project..."
	/opt/homebrew/Cellar/cmake/3.26.3/bin/cmake -P cmake_install.cmake
.PHONY : install/fast

# Special rule for the target install/local
install/local: preinstall
	@$(CMAKE_COMMAND) -E cmake_echo_color --switch=$(COLOR) --cyan "Installing only the local directory..."
	/opt/homebrew/Cellar/cmake/3.26.3/bin/cmake -DCMAKE_INSTALL_LOCAL_ONLY=1 -P cmake_install.cmake
.PHONY : install/local

# Special rule for the target install/local
install/local/fast: preinstall/fast
	@$(CMAKE_COMMAND) -E cmake_echo_color --switch=$(COLOR) --cyan "Installing only the local directory..."
	/opt/homebrew/Cellar/cmake/3.26.3/bin/cmake -DCMAKE_INSTALL_LOCAL_ONLY=1 -P cmake_install.cmake
.PHONY : install/local/fast

# Special rule for the target install/strip
install/strip: preinstall
	@$(CMAKE_COMMAND) -E cmake_echo_color --switch=$(COLOR) --cyan "Installing the project stripped..."
	/opt/homebrew/Cellar/cmake/3.26.3/bin/cmake -DCMAKE_INSTALL_DO_STRIP=1 -P cmake_install.cmake
.PHONY : install/strip

# Special rule for the target install/strip
install/strip/fast: preinstall/fast
	@$(CMAKE_COMMAND) -E cmake_echo_color --switch=$(COLOR) --cyan "Installing the project stripped..."
	/opt/homebrew/Cellar/cmake/3.26.3/bin/cmake -DCMAKE_INSTALL_DO_STRIP=1 -P cmake_install.cmake
.PHONY : install/strip/fast

# The main all target
all: cmake_check_build_system
	$(CMAKE_COMMAND) -E cmake_progress_start /Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build/CMakeFiles /Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build//CMakeFiles/progress.marks
	$(MAKE) $(MAKESILENT) -f CMakeFiles/Makefile2 all
	$(CMAKE_COMMAND) -E cmake_progress_start /Users/stefanomartire/miniforge3/envs/obiwan/lib/openmm-tensorflow/build/CMakeFiles 0
.PHONY : all

# The main clean target
clean:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/Makefile2 clean
.PHONY : clean

# The main clean target
clean/fast: clean
.PHONY : clean/fast

# Prepare targets for installation.
preinstall: all
	$(MAKE) $(MAKESILENT) -f CMakeFiles/Makefile2 preinstall
.PHONY : preinstall

# Prepare targets for installation.
preinstall/fast:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/Makefile2 preinstall
.PHONY : preinstall/fast

# clear depends
depend:
	$(CMAKE_COMMAND) -S$(CMAKE_SOURCE_DIR) -B$(CMAKE_BINARY_DIR) --check-build-system CMakeFiles/Makefile.cmake 1
.PHONY : depend

#=============================================================================
# Target rules for targets named OpenMMNN

# Build rule for target.
OpenMMNN: cmake_check_build_system
	$(MAKE) $(MAKESILENT) -f CMakeFiles/Makefile2 OpenMMNN
.PHONY : OpenMMNN

# fast build rule for target.
OpenMMNN/fast:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/build
.PHONY : OpenMMNN/fast

#=============================================================================
# Target rules for targets named CopyTestFiles

# Build rule for target.
CopyTestFiles: cmake_check_build_system
	$(MAKE) $(MAKESILENT) -f CMakeFiles/Makefile2 CopyTestFiles
.PHONY : CopyTestFiles

# fast build rule for target.
CopyTestFiles/fast:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/CopyTestFiles.dir/build.make CMakeFiles/CopyTestFiles.dir/build
.PHONY : CopyTestFiles/fast

#=============================================================================
# Target rules for targets named TestSerializeNeuralNetworkForce

# Build rule for target.
TestSerializeNeuralNetworkForce: cmake_check_build_system
	$(MAKE) $(MAKESILENT) -f CMakeFiles/Makefile2 TestSerializeNeuralNetworkForce
.PHONY : TestSerializeNeuralNetworkForce

# fast build rule for target.
TestSerializeNeuralNetworkForce/fast:
	$(MAKE) $(MAKESILENT) -f serialization/tests/CMakeFiles/TestSerializeNeuralNetworkForce.dir/build.make serialization/tests/CMakeFiles/TestSerializeNeuralNetworkForce.dir/build
.PHONY : TestSerializeNeuralNetworkForce/fast

#=============================================================================
# Target rules for targets named OpenMMNNReference

# Build rule for target.
OpenMMNNReference: cmake_check_build_system
	$(MAKE) $(MAKESILENT) -f CMakeFiles/Makefile2 OpenMMNNReference
.PHONY : OpenMMNNReference

# fast build rule for target.
OpenMMNNReference/fast:
	$(MAKE) $(MAKESILENT) -f platforms/reference/CMakeFiles/OpenMMNNReference.dir/build.make platforms/reference/CMakeFiles/OpenMMNNReference.dir/build
.PHONY : OpenMMNNReference/fast

#=============================================================================
# Target rules for targets named TestReferenceNeuralNetworkForce

# Build rule for target.
TestReferenceNeuralNetworkForce: cmake_check_build_system
	$(MAKE) $(MAKESILENT) -f CMakeFiles/Makefile2 TestReferenceNeuralNetworkForce
.PHONY : TestReferenceNeuralNetworkForce

# fast build rule for target.
TestReferenceNeuralNetworkForce/fast:
	$(MAKE) $(MAKESILENT) -f platforms/reference/tests/CMakeFiles/TestReferenceNeuralNetworkForce.dir/build.make platforms/reference/tests/CMakeFiles/TestReferenceNeuralNetworkForce.dir/build
.PHONY : TestReferenceNeuralNetworkForce/fast

#=============================================================================
# Target rules for targets named OpenMMNNOpenCL

# Build rule for target.
OpenMMNNOpenCL: cmake_check_build_system
	$(MAKE) $(MAKESILENT) -f CMakeFiles/Makefile2 OpenMMNNOpenCL
.PHONY : OpenMMNNOpenCL

# fast build rule for target.
OpenMMNNOpenCL/fast:
	$(MAKE) $(MAKESILENT) -f platforms/opencl/CMakeFiles/OpenMMNNOpenCL.dir/build.make platforms/opencl/CMakeFiles/OpenMMNNOpenCL.dir/build
.PHONY : OpenMMNNOpenCL/fast

#=============================================================================
# Target rules for targets named TestOpenCLNeuralNetworkForce

# Build rule for target.
TestOpenCLNeuralNetworkForce: cmake_check_build_system
	$(MAKE) $(MAKESILENT) -f CMakeFiles/Makefile2 TestOpenCLNeuralNetworkForce
.PHONY : TestOpenCLNeuralNetworkForce

# fast build rule for target.
TestOpenCLNeuralNetworkForce/fast:
	$(MAKE) $(MAKESILENT) -f platforms/opencl/tests/CMakeFiles/TestOpenCLNeuralNetworkForce.dir/build.make platforms/opencl/tests/CMakeFiles/TestOpenCLNeuralNetworkForce.dir/build
.PHONY : TestOpenCLNeuralNetworkForce/fast

openmmapi/src/NeuralNetworkForce.o: openmmapi/src/NeuralNetworkForce.cpp.o
.PHONY : openmmapi/src/NeuralNetworkForce.o

# target to build an object file
openmmapi/src/NeuralNetworkForce.cpp.o:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForce.cpp.o
.PHONY : openmmapi/src/NeuralNetworkForce.cpp.o

openmmapi/src/NeuralNetworkForce.i: openmmapi/src/NeuralNetworkForce.cpp.i
.PHONY : openmmapi/src/NeuralNetworkForce.i

# target to preprocess a source file
openmmapi/src/NeuralNetworkForce.cpp.i:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForce.cpp.i
.PHONY : openmmapi/src/NeuralNetworkForce.cpp.i

openmmapi/src/NeuralNetworkForce.s: openmmapi/src/NeuralNetworkForce.cpp.s
.PHONY : openmmapi/src/NeuralNetworkForce.s

# target to generate assembly for a file
openmmapi/src/NeuralNetworkForce.cpp.s:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForce.cpp.s
.PHONY : openmmapi/src/NeuralNetworkForce.cpp.s

openmmapi/src/NeuralNetworkForceImpl.o: openmmapi/src/NeuralNetworkForceImpl.cpp.o
.PHONY : openmmapi/src/NeuralNetworkForceImpl.o

# target to build an object file
openmmapi/src/NeuralNetworkForceImpl.cpp.o:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForceImpl.cpp.o
.PHONY : openmmapi/src/NeuralNetworkForceImpl.cpp.o

openmmapi/src/NeuralNetworkForceImpl.i: openmmapi/src/NeuralNetworkForceImpl.cpp.i
.PHONY : openmmapi/src/NeuralNetworkForceImpl.i

# target to preprocess a source file
openmmapi/src/NeuralNetworkForceImpl.cpp.i:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForceImpl.cpp.i
.PHONY : openmmapi/src/NeuralNetworkForceImpl.cpp.i

openmmapi/src/NeuralNetworkForceImpl.s: openmmapi/src/NeuralNetworkForceImpl.cpp.s
.PHONY : openmmapi/src/NeuralNetworkForceImpl.s

# target to generate assembly for a file
openmmapi/src/NeuralNetworkForceImpl.cpp.s:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForceImpl.cpp.s
.PHONY : openmmapi/src/NeuralNetworkForceImpl.cpp.s

serialization/src/NeuralNetworkForceProxy.o: serialization/src/NeuralNetworkForceProxy.cpp.o
.PHONY : serialization/src/NeuralNetworkForceProxy.o

# target to build an object file
serialization/src/NeuralNetworkForceProxy.cpp.o:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/serialization/src/NeuralNetworkForceProxy.cpp.o
.PHONY : serialization/src/NeuralNetworkForceProxy.cpp.o

serialization/src/NeuralNetworkForceProxy.i: serialization/src/NeuralNetworkForceProxy.cpp.i
.PHONY : serialization/src/NeuralNetworkForceProxy.i

# target to preprocess a source file
serialization/src/NeuralNetworkForceProxy.cpp.i:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/serialization/src/NeuralNetworkForceProxy.cpp.i
.PHONY : serialization/src/NeuralNetworkForceProxy.cpp.i

serialization/src/NeuralNetworkForceProxy.s: serialization/src/NeuralNetworkForceProxy.cpp.s
.PHONY : serialization/src/NeuralNetworkForceProxy.s

# target to generate assembly for a file
serialization/src/NeuralNetworkForceProxy.cpp.s:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/serialization/src/NeuralNetworkForceProxy.cpp.s
.PHONY : serialization/src/NeuralNetworkForceProxy.cpp.s

serialization/src/NeuralNetworkSerializationProxyRegistration.o: serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.o
.PHONY : serialization/src/NeuralNetworkSerializationProxyRegistration.o

# target to build an object file
serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.o:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.o
.PHONY : serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.o

serialization/src/NeuralNetworkSerializationProxyRegistration.i: serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.i
.PHONY : serialization/src/NeuralNetworkSerializationProxyRegistration.i

# target to preprocess a source file
serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.i:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.i
.PHONY : serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.i

serialization/src/NeuralNetworkSerializationProxyRegistration.s: serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.s
.PHONY : serialization/src/NeuralNetworkSerializationProxyRegistration.s

# target to generate assembly for a file
serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.s:
	$(MAKE) $(MAKESILENT) -f CMakeFiles/OpenMMNN.dir/build.make CMakeFiles/OpenMMNN.dir/serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.s
.PHONY : serialization/src/NeuralNetworkSerializationProxyRegistration.cpp.s

# Help Target
help:
	@echo "The following are some of the valid targets for this Makefile:"
	@echo "... all (the default if no target is provided)"
	@echo "... clean"
	@echo "... depend"
	@echo "... edit_cache"
	@echo "... install"
	@echo "... install/local"
	@echo "... install/strip"
	@echo "... list_install_components"
	@echo "... rebuild_cache"
	@echo "... test"
	@echo "... CopyTestFiles"
	@echo "... OpenMMNN"
	@echo "... OpenMMNNOpenCL"
	@echo "... OpenMMNNReference"
	@echo "... TestOpenCLNeuralNetworkForce"
	@echo "... TestReferenceNeuralNetworkForce"
	@echo "... TestSerializeNeuralNetworkForce"
	@echo "... openmmapi/src/NeuralNetworkForce.o"
	@echo "... openmmapi/src/NeuralNetworkForce.i"
	@echo "... openmmapi/src/NeuralNetworkForce.s"
	@echo "... openmmapi/src/NeuralNetworkForceImpl.o"
	@echo "... openmmapi/src/NeuralNetworkForceImpl.i"
	@echo "... openmmapi/src/NeuralNetworkForceImpl.s"
	@echo "... serialization/src/NeuralNetworkForceProxy.o"
	@echo "... serialization/src/NeuralNetworkForceProxy.i"
	@echo "... serialization/src/NeuralNetworkForceProxy.s"
	@echo "... serialization/src/NeuralNetworkSerializationProxyRegistration.o"
	@echo "... serialization/src/NeuralNetworkSerializationProxyRegistration.i"
	@echo "... serialization/src/NeuralNetworkSerializationProxyRegistration.s"
.PHONY : help



#=============================================================================
# Special targets to cleanup operation of make.

# Special rule to run CMake to check the build system integrity.
# No rule that depends on this can have commands that come from listfiles
# because they might be regenerated.
cmake_check_build_system:
	$(CMAKE_COMMAND) -S$(CMAKE_SOURCE_DIR) -B$(CMAKE_BINARY_DIR) --check-build-system CMakeFiles/Makefile.cmake 0
.PHONY : cmake_check_build_system

[unlucio]

I'm having the same problem, stuck at build with those errors
(might be the old age but I feel ./configure && make && make install were better at reporting errors than ccmake's UI)

[peastman]

That probably means you have OPENMM_DIR set incorrectly. It should point to the base of your OpenMM installation. Inside that directory, there should be another directory called include which contains another directory called openmm.

[unlucio]

I tried cloning openmm pointing OPENMM_DIR to the repo's dir but ccmakeenv's screen was still showing OPENMM_DIR=/usr/local/openmm, so I compiled openmm which got correctly installed to /usr/local/openmm:

but when I try to compile

thalia openmm-tensorflow (master?) # make
[  7%] Building CXX object CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForce.cpp.o
In file included from /root/test/openmm-tensorflow/openmmapi/src/NeuralNetworkForce.cpp:33:
/root/test/openmm-tensorflow/openmmapi/include/internal/NeuralNetworkForceImpl.h:38:10: fatal error: c_api.h: No such file or directory
   38 | #include <c_api.h>
      |          ^~~~~~~~~
compilation terminated.
make[2]: *** [CMakeFiles/OpenMMNN.dir/build.make:76: CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForce.cpp.o] Error 1
make[1]: *** [CMakeFiles/Makefile2:137: CMakeFiles/OpenMMNN.dir/all] Error 2
make: *** [Makefile:146: all] Error 2

thalia is an Ubuntu 22.10 running:

make -version
GNU Make 4.3
Built for x86_64-pc-linux-gnu
Copyright (C) 1988-2020 Free Software Foundation, Inc.
License GPLv3+: GNU GPL version 3 or later <http://gnu.org/licenses/gpl.html>
This is free software: you are free to change and redistribute it.
There is NO WARRANTY, to the extent permitted by law.

cmake --version
cmake version 3.24.2

CMake suite maintained and supported by Kitware (kitware.com/cmake).

ldd --version
ldd (Ubuntu GLIBC 2.36-0ubuntu4) 2.36
Copyright (C) 2022 Free Software Foundation, Inc.
This is free software; see the source for copying conditions.  There is NO
warranty; not even for MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.
Written by Roland McGrath and Ulrich Drepper.

 gcc --version
gcc (Ubuntu 12.2.0-3ubuntu1) 12.2.0
Copyright (C) 2022 Free Software Foundation, Inc.
This is free software; see the source for copying conditions.  There is NO
warranty; not even for MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.

Since the repo's code is so old - I don't mean it in a negative way, "if it ain't broken don't fix it", tho toolings and environments around it might have changed meanwhile - can you share infos on an environment that is sure to be able to compile this library?

[peastman]

I tried cloning openmm pointing OPENMM_DIR to the repo's dir

It needs to point to the installed package, not the source code repo.

I haven't done anything with TensorFlow in years. The field has mostly standardized on PyTorch, so that's where all our current development work is focused. See https://github.com/openmm/openmm-torch. If current versions of TensorFlow require changes to compile, a PR with the changes would be welcome.

[unlucio]

As said in the prev post openmm was compiled and installed in /usr/local/openmm, since simply compiling it in place and pointing OPENMM_DIR to wasn't pick up by ccmake who would still display OPENMM_DIR=/usr/local/openmm.
You can see in the screenshot I posted that /usr/local/openmm looks coherent with your suggestions, yet compilation still booms on me with:

thalia openmm-tensorflow (master?) # make
[  7%] Building CXX object CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForce.cpp.o
In file included from /root/test/openmm-tensorflow/openmmapi/src/NeuralNetworkForce.cpp:33:
/root/test/openmm-tensorflow/openmmapi/include/internal/NeuralNetworkForceImpl.h:38:10: fatal error: c_api.h: No such file or directory
   38 | #include <c_api.h>
      |          ^~~~~~~~~
compilation terminated.
make[2]: *** [CMakeFiles/OpenMMNN.dir/build.make:76: CMakeFiles/OpenMMNN.dir/openmmapi/src/NeuralNetworkForce.cpp.o] Error 1
make[1]: *** [CMakeFiles/Makefile2:137: CMakeFiles/OpenMMNN.dir/all] Error 2
make: *** [Makefile:146: all] Error 2

I'll be more than happy to send over some good Docker PR, so nobody else will need to deal with compilation dependencies like it was the 90s 😆, once I figure out how to compile it 😅. That was the intrinsic direction asking about an environment that can compile it, so I can reproduce it with Docker.

[peastman]

c_api.h contains the TensorFlow C API. It gets located based on TENSORFLOW_DIR:

openmm-tensorflow/CMakeLists.txt

Line 14 in c9a0e09

INCLUDE_DIRECTORIES("${TENSORFLOW_DIR}/include/tensorflow/c")

You have it set to /usr/local. Since you installed it with conda, that's probably not the correct location.