gitmyhub

Hbind

C ★ 27 updated 6y ago

Calculates hydrogen-bond interaction tables for protein-small molecule complexes, based on protein PDB and protonated ligand MOL2 structure input. Raschka et al. (2018) J. Computer-Aided Molec. Design

No plain-English explanation yet — one is being written right now. Check back in a minute.