Work

D3R Grand Challenge 3: blind prediction of protein–ligand poses and affinity rankings

Year: 2019

Type: article

Source: Journal of Computer-Aided Molecular Design

DOI: 10.1007/s10822-018-0180-4

Authors: Zied Gaieb, Conor D. Parks, Michael Chiu, Huanwang Yang, Chenghua Shao, W. Patrick Walters, Millard H. Lambert, Neysa Nevins, Scott D. Bembenek, Michael K. Ameriks, Tara Mirzadegan, Stephen K. Burley, Rommie E. Amaro, Michael K. Gilson

Institutions: University of California San Diego, Rutgers, The State University of New Jersey, Relay Therapeutics (United States), GlaxoSmithKline (United States), Janssen Research & Development (United States), Rutgers Cancer Institute

Language: English

Topic: Computational Drug Discovery Methods

Subfield: Computational Theory and Mathematics

Field: Computer Science

Domain: Physical Sciences

Open Access status: green

Funders: National Science Foundation, National Institutes of Health, National Institute of General Medical Sciences

Awards: PDB Management by the Research Collaboratory for Structural Bioinformatics, AN OPEN RESOURCE TO ADVANCE COMPUTER-AIDED DRUG DESIGN

OpenAlex ID: W2910318997

FWCI: 13.75

Cites: 47

Cited by: 137

Related to: 10