https://github.com/AdaptivePELE/AdaptivePELE
Tip revision: 14cd2e598c5dc55af8d97793ef572d6dbf18b59c authored by jgilaber on 28 September 2020, 08:54:04 UTC
Merge branch 'multiple_ligands' of /gpfs/projects/bsc72/adaptiveSampling/adaptivePELE into multiple_ligands
Merge branch 'multiple_ligands' of /gpfs/projects/bsc72/adaptiveSampling/adaptivePELE into multiple_ligands
Tip revision: 14cd2e5
.gitignore
AdaptivePELE/*/*.pyc
AdaptivePELE/*/*.sw[op]
AdaptivePELE/epsilon_values.txt
AdaptivePELE/.ropeproject/
AdaptivePELE/os
AdaptivePELE/setuptools
AdaptivePELE/sys
AdaptivePELE/build/
AdaptivePELE/atomset/*.c
AdaptivePELE/atomset/*.so
AdaptivePELE/atomset/build
AdaptivePELE/freeEnergies/*.c
AdaptivePELE/freeEnergies/*.so
AdaptivePELE/freeEnergies/build
AdaptivePELE/Data
AdaptivePELE/Documents
AdaptivePELE/docs/_build
AdaptivePELE/AdaptiveTest.*
AdaptivePELE/MDTest.*
setup.pyc
.ropeproject
build
AdaptivePELE/*.pyc
*.sw[op]
AdaptivePELE/tmp_tests_data_3ptb_data_Test3/
AdaptivePELE/tests/data/3ptb_data/Test3/
AdaptivePELE/tests/data/3ptb_data/RestartTest/*/logFile*
.DS_Store
dist
AdaptivePELE.egg-info/
AdaptivePELE/__pycache__
AdaptivePELE/*/__pycache__
.idea
AdaptivePELE/AdaptiveTest_CUDA.*
