ACS Omega (Aug 2016)
Predicting Binding Affinities for GPCR Ligands Using Free-Energy Perturbation
- Eelke B. Lenselink,
- Julien Louvel,
- Anna F. Forti,
- Jacobus P. D. van Veldhoven,
- Henk de Vries,
- Thea Mulder-Krieger,
- Fiona M. McRobb,
- Ana Negri,
- Joseph Goose,
- Robert Abel,
- Herman W. T. van Vlijmen,
- Lingle Wang,
- Edward Harder,
- Woody Sherman,
- Adriaan P. IJzerman,
- Thijs Beuming
Affiliations
- Eelke B. Lenselink
- Division of Medicinal Chemistry, Leiden Academic Centre for Drug Research, Leiden University, The Netherlands
- Julien Louvel
- Division of Medicinal Chemistry, Leiden Academic Centre for Drug Research, Leiden University, The Netherlands
- Anna F. Forti
- Division of Medicinal Chemistry, Leiden Academic Centre for Drug Research, Leiden University, The Netherlands
- Jacobus P. D. van Veldhoven
- Division of Medicinal Chemistry, Leiden Academic Centre for Drug Research, Leiden University, The Netherlands
- Henk de Vries
- Division of Medicinal Chemistry, Leiden Academic Centre for Drug Research, Leiden University, The Netherlands
- Thea Mulder-Krieger
- Division of Medicinal Chemistry, Leiden Academic Centre for Drug Research, Leiden University, The Netherlands
- Fiona M. McRobb
- Schrödinger, Inc., United States
- Ana Negri
- Schrödinger, Inc., United States
- Joseph Goose
- Schrödinger, Inc., United States
- Robert Abel
- Schrödinger, Inc., United States
- Herman W. T. van Vlijmen
- Division of Medicinal Chemistry, Leiden Academic Centre for Drug Research, Leiden University, The Netherlands
- Lingle Wang
- Schrödinger, Inc., United States
- Edward Harder
- Schrödinger, Inc., United States
- Woody Sherman
- Schrödinger, Inc., United States
- Adriaan P. IJzerman
- Division of Medicinal Chemistry, Leiden Academic Centre for Drug Research, Leiden University, The Netherlands
- Thijs Beuming
- Schrödinger, Inc., United States
- DOI
- https://doi.org/10.1021/acsomega.6b00086
- Journal volume & issue
-
Vol. 1,
no. 2
pp. 293 – 304
Abstract
No abstracts available.
