FlexVDW: A machine learning approach to account for protein flexibility in ligand docking.

Patricia Suriana Joseph M. Paggi Ron O. Dror

Published in: CoRR (2023)

Keyphrases

ligand docking
amino acids
protein sequences
protein structure prediction
subcellular localization
database
data sets
information retrieval
feature selection
protein function
amino acid sequences
chemical compounds
contact map
cellular processes