Pinned Repositories
FPSim2
Simple package for fast molecular similarity searches
Vina-GPU-2.0
Vina-GPU 2.0 accelerates AutoDock Vina and its related commonly derived docking methods, such as QuickVina 2 and QuickVina-W with GPUs.
reactiondataextractor2
This repo contains ReactionDataExtractor v.2 - software toolkit for extraction of information from chemical reaction schemes
Seungju88's Repositories
Seungju88/RoseTTAFold-All-Atom
RoseTTAFol-All-Atom