PyRMD: A New Fully Automated AI-Powered Ligand-Based Virtual Screening Tool.

Giorgio Amendola Sandro Cosconati

Published in: J. Chem. Inf. Model. (2021)

Keyphrases

fully automated
virtual screening
drug discovery
fully automatic
chemical structures
similarity searching
high throughput
binding sites
similarity search
database
machine learning
data mining
database systems
biological data