Applications

PocketQuery

PocketQuery is a web service for interactively exploring not only hot spot and anchor residues, but hot regions, defined by clusters of residues, at the interface of protein-protein interactions.

ZincPharmer

Exact Pharmacophore search of 18 million compounds from the ZINC database.

AnchorQuery

Pharmacophore search of 31 million multiple-component reaction (MCR), synthetically available compounds. Chemistry biased to inhibit protein-protein interactions.

smina

A fork of Autodock Vina with a number of algorithmic and usability improvements. Allows for user customizable force fields.

Pharmer

Open-source exact pharmacophore search technology. Used to power ZincPharmer.

SIMPLE