Closed gorgW closed 5 days ago
README contains a command to check why the HIP platform is not loaded. What does it print?
---Loaded--- /opt/conda/envs/openmm-env/lib/plugins/libOpenMMPME.so /opt/conda/envs/openmm-env/lib/plugins/libOpenMMCPU.so /opt/conda/envs/openmm-env/lib/plugins/libOpenMMOpenCL.so /opt/conda/envs/openmm-env/lib/plugins/libOpenMMRPMDOpenCL.so /opt/conda/envs/openmm-env/lib/plugins/libOpenMMDrudeOpenCL.so /opt/conda/envs/openmm-env/lib/plugins/libOpenMMAmoebaOpenCL.so /opt/conda/envs/openmm-env/lib/plugins/libOpenMMRPMDReference.so /opt/conda/envs/openmm-env/lib/plugins/libOpenMMDrudeReference.so /opt/conda/envs/openmm-env/lib/plugins/libOpenMMAmoebaReference.so ---Failed--- Error loading library /opt/conda/envs/openmm-env/lib/plugins/libOpenMMHIP.so: libhipfft.so.0: cannot open shared object file: No such file or directory Error loading library /opt/conda/envs/openmm-env/lib/plugins/libOpenMMCUDA.so: libcuda.so.1: cannot open shared object file: No such file or directory Error loading library /opt/conda/envs/openmm-env/lib/plugins/libOpenMMRPMDHIP.so: libhipfft.so.0: cannot open shared object file: No such file or directory Error loading library /opt/conda/envs/openmm-env/lib/plugins/libOpenMMDrudeHIP.so: libhipfft.so.0: cannot open shared object file: No such file or directory Error loading library /opt/conda/envs/openmm-env/lib/plugins/libOpenMMRPMDCUDA.so: libcuda.so.1: cannot open shared object file: No such file or directory Error loading library /opt/conda/envs/openmm-env/lib/plugins/libOpenMMDrudeCUDA.so: libcuda.so.1: cannot open shared object file: No such file or directory Error loading library /opt/conda/envs/openmm-env/lib/plugins/libOpenMMAmoebaHIP.so: libhipfft.so.0: cannot open shared object file: No such file or directory Error loading library /opt/conda/envs/openmm-env/lib/plugins/libOpenMMAmoebaCUDA.so: libcuda.so.1: cannot open shared object file: No such file or directory Error loading library /opt/conda/envs/openmm-env/lib/plugins/libOpenMMHipCompiler.so: libamdhip64.so.6: cannot open shared object file: No such file or directory
Install hipfft, see README.
What ROCm version do you have, btw?
If the old 5. then you might need to install openmm-hip==8.0.0
, if the newer 6. then openmm-hip==8.1.1beta
should work (for this version you don't need to install hipfft).
This is helpful. Thanks.
When I build the plugin, it works fine and hip platform is there, while when I use Conda in creating the environment using this line conda create -n openmm-env -c streamhpc -c conda-forge --strict-channel-priority openmm-hip and I run the test python -m openmm.testInstallation HIP platform is not there.
any idea what might cause this ?