Application of Mixed-Solvent Molecular Dynamics Simulations for Prediction of Allosteric Sites on G Protein–Coupled Receptors

Wallace K.B. Chan; Heather A. Carlson; John R. Traynor

doi:10.1124/molpharm.122.000612

Research ArticleArticle

Application of Mixed-Solvent Molecular Dynamics Simulations for Prediction of Allosteric Sites on G Protein–Coupled Receptors

Wallace K.B. Chan, Heather A. Carlson and John R. Traynor

Molecular Pharmacology May 2023, 103 (5) 274-285; DOI: https://doi.org/10.1124/molpharm.122.000612

Wallace K.B. Chan

Department of Pharmacology and Edward F. Domino Research Center (W.K.B.C., J.R.T.) and Department of Medicinal Chemistry (H.A.C., J.R.T.), University of Michigan, Ann Arbor, Michigan

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Heather A. Carlson

Department of Pharmacology and Edward F. Domino Research Center (W.K.B.C., J.R.T.) and Department of Medicinal Chemistry (H.A.C., J.R.T.), University of Michigan, Ann Arbor, Michigan

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John R. Traynor

Department of Pharmacology and Edward F. Domino Research Center (W.K.B.C., J.R.T.) and Department of Medicinal Chemistry (H.A.C., J.R.T.), University of Michigan, Ann Arbor, Michigan

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Molecular Pharmacology

Vol. 103, Issue 5

1 May 2023

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Research ArticleArticle

Mixed-Solvent MD Simulations Applied to GPCRs

Wallace K.B. Chan, Heather A. Carlson and John R. Traynor

Molecular Pharmacology May 1, 2023, 103 (5) 274-285; DOI: https://doi.org/10.1124/molpharm.122.000612

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Research ArticleArticle

Mixed-Solvent MD Simulations Applied to GPCRs

Wallace K.B. Chan, Heather A. Carlson and John R. Traynor

Molecular Pharmacology May 1, 2023, 103 (5) 274-285; DOI: https://doi.org/10.1124/molpharm.122.000612

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