OpenFE 2024 Industry Benchmarking Project, Results from Janssen, public sets
收藏官方服务：
资源简介：
OpenFE 2024 Industry Benchmarking Project. Results from systems fragments_mcl1, fragments_t4_lysozyme, waterset_chk1, waterset_hsp90_kung, waterset_taf12, waterset_thrombin, waterset_hsp90_woodhead, waterset_scytalone_dehydratase, waterset_urokinase. OpenFE version v1.0.1. Simulation details can be found in the GitHub repository https://github.com/OpenFreeEnergy/IndustryBenchmarks2024
提供机构：
Zenodo创建时间：
2024-12-18
