Import base code for Python-driven simulation from gmxapi 0.0.7.4.
tree89f5d3aefd5740f07669b6114c8350393e1294af
-rw-r--r-- 2721 .clang-format
-rw-r--r-- 350 .dockerignore
-rw-r--r-- 2903 .gitattributes
-rw-r--r-- 224 .gitignore
-rw-r--r-- 267 AUTHORS
-rw-r--r-- 36191 CMakeLists.txt
-rw-r--r-- 73190 COPYING
-rw-r--r-- 3813 CPackInit.cmake
-rw-r--r-- 1996 CTestConfig.cmake
-rw-r--r-- 766 INSTALL-dev
-rw-r--r-- 4400 README
drwxr-xr-x - admin
drwxr-xr-x - cmake
drwxr-xr-x - docs
drwxr-xr-x - python_packaging
drwxr-xr-x - scripts
drwxr-xr-x - share
drwxr-xr-x - src
drwxr-xr-x - tests