MiaoLab20/gamd-openmm
Gaussian Accelerated Molecular Dynamics (GaMD) is a computational method for both unconstrained enhanced sampling and free energy calculations of biomolecules. It works by adding a harmonic boost potential to smooth the potential energy surface and reduce system energy barriers. http://miao.compbio.ku.edu/GaMD/
PythonMIT
Stargazers
- AdrienCerdanFrance
- allyksmith23
- Bio-OttoMarmara University/ Computational Biology and Bioinformatics Lab
- CoryKornowicz
- DanielWicz
- darianyangPittsburgh, PA
- ddh101
- dyelarLawrence, KS
- HBioquantPeking University
- jchoderaMemorial Sloan Kettering Cancer Center
- jeetain
- jRicciL
- kangsgoHunan,Changsha
- kousik167
- leelasdYale University
- likun1212
- lvotapka
- mackevinbrazaUniversity of California San Diego
- mdpoletoVirginia Tech
- NatureGeorgePKU
- pablo-arantesUniversity of California,
- Panda-DaLong
- rohithmohanCalifornia
- saguileranUniversidad Nacional de Colombia
- sailfish009freelancer
- Scioratis
- sct1g15
- suan12
- tcsnndZhejiang University
- TienMPhanTexas A&M University
- tiger-tigerSHANGHAI
- VincenzoChenNational Institute of Biological Sciences, Beijing
- wowfee
- xhhwhc
- ytworks
- ZCLIU-2022