Zobrazeno 1 - 5
of 5
pro vyhledávání: '"Evelyne Houang"'
Autor:
Gregory A. Ross, Chao Lu, Guido Scarabelli, Steven K. Albanese, Evelyne Houang, Robert Abel, Edward D. Harder, Lingle Wang
Publikováno v:
Communications Chemistry, Vol 6, Iss 1, Pp 1-12 (2023)
Abstract Computational techniques can speed up the identification of hits and accelerate the development of candidate molecules for drug discovery. Among techniques for predicting relative binding affinities, the most consistently accurate is free en
Externí odkaz:
https://doaj.org/article/79d1308e170847339a53931494a3e639
Autor:
Gregory Ross, Chao Lu, Guido Scarabelli, Steven Albanese, Evelyne Houang, Robert Abel, Edward Harder, Lingle Wang
It is now well recognized that computational techniques can greatly speed up the identification of hits and accelerate the optimization of such hits to lead series and development candidate molecules. In particular, a class of rigorous physics-based
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4229da63cf39760789be87ae2dcce01f
https://doi.org/10.21203/rs.3.rs-2179899/v1
https://doi.org/10.21203/rs.3.rs-2179899/v1
Autor:
Haifeng Tang, Kristian Jensen, Evelyne Houang, Fiona M. McRobb, Sathesh Bhat, Mats Svensson, Art Bochevarov, Tyler Day, Markus K. Dahlgren, Jeffery A. Bell, Leah Frye, Robert J. Skene, James H. Lewis, James D. Osborne, Jason P. Tierney, James A. Gordon, Maria A. Palomero, Caroline Gallati, Robert S. L. Chapman, Daniel R. Jones, Kim L. Hirst, Mark Sephton, Alka Chauhan, Andrew Sharpe, Piero Tardia, Elsa A. Dechaux, Andrea Taylor, Ross D. Waddell, Andrea Valentine, Holden B. Janssens, Omar Aziz, Dawn E. Bloomfield, Sandeep Ladha, Ian J. Fraser, John M. Ellard
Publikováno v:
Journal of medicinal chemistry. 65(9)
d-Serine is a coagonist of the
Autor:
Ross, Gregory A.1,2 (AUTHOR) gregoryaross@isomorphiclabs.com, Lu, Chao1 (AUTHOR), Scarabelli, Guido3 (AUTHOR), Albanese, Steven K.1 (AUTHOR), Houang, Evelyne1 (AUTHOR), Abel, Robert1 (AUTHOR), Harder, Edward D.1 (AUTHOR), Wang, Lingle1 (AUTHOR) lingle.wang@schrodinger.com
Publikováno v:
Communications Chemistry. 10/14/2023, Vol. 6 Issue 1, p1-12. 12p.
Autor:
Kira A. Armacost, David C. Thompson, Zoe Cournia, Christophe Chipot, Benoît Roux, Darrin M. York, Woody Sherman, Katharina Meier, Joseph P. Bluck, Clara D. Christ, Nicolas Tielker, Lukas Eberlein, Oliver Beckstein, Stefan Güssregen, Bogdan I. Iorga, Stefan M. Kast, Shuai Liu, Miroslav Suruzhon, Marley L. Samways, Jonathan W. Essex, Ayşegül Özen, Emanuele Perola, Natasja Brooijmans, Joseph Kim, Dilek Coskun, Tai-Sung Lee, Hsu-Chun Tsai, Abir Ganguly, Timothy J. Giese, Jennifer L. Knight, Karl Leswing, Pieter H. Bos, Lingle Wang, Paul Labute, Maximilian Ebert, Lance M. Westerhoff, Zheng Zheng, Eric C. Gladstone
'This book is about Free Energy Methods in Drug Discovery: Current State and Future Directions'--