📣 Help Shape the Future of UKRI's Gateway to Research (GtR)

We're improving UKRI's Gateway to Research and are seeking your input! If you would be interested in being interviewed about the improvements we're making and to have your say about how we can make GtR more user-friendly, impactful, and effective for the Research and Innovation community, please email gateway@ukri.org.

BRD4: quantum mechanical protein-ligand binding free energies using the full-protein DFT-based QM-PBSA method. (2022)

First Author: Gundelach L

Attributed to: Support for the UKCP consortium funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1039/d2cp03705j

PubMed Identifier: 36222107

Publication URI: http://europepmc.org/abstract/MED/36222107

Type: Journal Article/Review

Volume: 24

Parent Publication: Physical chemistry chemical physics : PCCP

Issue: 41

ISSN: 1463-9076