Author: Róbert Kiss


Mcule: Cloud computing, Instant Quote & Delivery

May 19, 2015 - Presentation
Mcule is an online drug discovery platform. It is combining cloud infrastructure with molecular modeling tools and an easy-to-use web interface. With its customizable tools Mcule can be u…

Virtual Fragment Docking by Glide: a Validation Study on 190 Protein-Fragment Complexes

May 11, 2010 - Publication
The docking accuracy of Glide was evaluated using 16 different docking protocols on 190 protein−fragment complexes representing 78 targets. Standard precision docking (Glide SP) based p…

GPCR fragment design: A case study of using drug discovery tools at

May 22, 2012 - Poster
G-protein-coupled receptors (GPCR) are attractive drug targets as their dysfunction can be associated with a large number of diseases. Several class “A” GPCR crystal structure…