📣 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.

Automated Adaptive Absolute Binding Free Energy Calculations. (2024)

First Author: Clark F

Attributed to: Next generation atomistic modelling for medicinal chemistry and biology funded by UKRI FLF

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jctc.4c00806

PubMed Identifier: 39254715

Publication URI: http://europepmc.org/abstract/MED/39254715

Type: Journal Article/Review

Volume: 20

Parent Publication: Journal of chemical theory and computation

Issue: 18

ISSN: 1549-9618