Run docking study from python #chemoinformatics #vina #RDKit

Docking is one of the popular approach for computer aided drug design. There are lots of applications to run docking not only commercial software but also open source. AutoDock Vina is one of the popular OSS for docking study and it was updated recently. The publication is below. https://pubs.acs.org/doi/full/10.1021/acs.jcim.1c00203 Vina has python binding and it