build: Use the PyPi version of OpenMM

RBVI · Dec 20, 2024 · fbe7f51 · fbe7f51
1 parent ca4bc2b
commit fbe7f51
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Showing 9 changed files with 2 additions and 333 deletions.
diff --git a/prereqs/Makefile b/prereqs/Makefile
@@ -56,7 +56,7 @@ endif
 .NOTPARALLEL:
 
 # keep in alphabetical order, dependencies go below
-SUBDIRS	+= ambertools openmm pips PyQt Python
+SUBDIRS	+= ambertools pips PyQt Python
 
 
 # All needed subdirectories must be set by now.

diff --git a/prereqs/openmm/Makefile b/prereqs/openmm/Makefile
diff --git a/prereqs/openmm/OpenMM-Windows-plugins.patch b/prereqs/openmm/OpenMM-Windows-plugins.patch
diff --git a/prereqs/openmm/README.txt b/prereqs/openmm/README.txt
diff --git a/prereqs/openmm/openmm_linux_compile/README.txt b/prereqs/openmm/openmm_linux_compile/README.txt
diff --git a/prereqs/openmm/openmm_linux_compile/build.sh b/prereqs/openmm/openmm_linux_compile/build.sh
diff --git a/prereqs/openmm/openmm_linux_compile/centos-7-devtoolset-9-cuda.def b/prereqs/openmm/openmm_linux_compile/centos-7-devtoolset-9-cuda.def
diff --git a/prereqs/openmm/openmm_linux_compile/run.sh b/prereqs/openmm/openmm_linux_compile/run.sh
diff --git a/prereqs/pips/app_requirements.txt b/prereqs/pips/app_requirements.txt
@@ -33,6 +33,7 @@ netCDF4==1.6.5
 networkx==3.3
 numpy==1.26.4
 openvr==1.26.701
+openmm==8.2.0
 packaging==23.2
 # as per Tristan's request in ticket #3055
 ParmEd==4.2.2