protocaller/ProtoCaller
Full automation of relative protein-ligand binding free energy calculations in GROMACS
PythonGPL-3.0
Stargazers
- bergazin@MobleyLab
- bhwl12
- BioHub-126
- CMargreitterAstraZeneca
- CoryKornowicz
- DrAwwa
- essex-labUniversity of Southampton
- hannahbrucemacdonaldChodera Lab // MSKCC
- HBioquantPeking University
- HCl0906
- hminhhung
- hugecaddSimcere
- jaimergp@quansight
- jchoderaMemorial Sloan Kettering Cancer Center
- jeah-z
- JoanDu2017
- JustinDoItTianjin Institute of Industrial Biotechnology, Chinese Academy of Sciences
- ldanduo
- leelasdYale University
- lohedgesOpenBioSim
- MorganCThomasUniversitat Pompeu Fabra
- mukherjeesutanuindia
- Neo-FlashEast China Normal University
- pallavsen007IIT Guwahati
- pkiruba@karanicolaslab
- quantaosunUNSW, Sydney
- rociomerChalmers University of Technology
- shiyx409University College London, SoP
- simonbrayGain Therapeutics
- sunshinehps
- TienMPhanTexas A&M University
- tsenapathiUniversity of Sri Jayewardenepura
- UnixJunkieThe University of Tokyo
- yipy0005Singapore
- ZCLIU-2022
- zhenglzTencent