a high-throughput alchemical free energy execution system for use with HPC, cloud, bare metal, and Folding@Home
(35 stars) (10 forks) (5 個已索引 issue) (5 個開放 good first issue)
倉庫
倉庫
a high-throughput alchemical free energy execution system for use with HPC, cloud, bare metal, and Folding@Home