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Relative Binding Free-Energy Calculations at Lipid-Exposed Sites: Deciphering Hot Spots.
Dickson, Callum J; Hornak, Viktor; Duca, Jose S.
Affiliation
  • Dickson CJ; Computer-Aided Drug Discovery, Global Discovery Chemistry, Novartis Institutes for BioMedical Research, 181 Massachusetts Avenue, Cambridge, Massachusetts 02139, United States.
  • Hornak V; Computer-Aided Drug Discovery, Global Discovery Chemistry, Novartis Institutes for BioMedical Research, 181 Massachusetts Avenue, Cambridge, Massachusetts 02139, United States.
  • Duca JS; Computer-Aided Drug Discovery, Global Discovery Chemistry, Novartis Institutes for BioMedical Research, 181 Massachusetts Avenue, Cambridge, Massachusetts 02139, United States.
J Chem Inf Model ; 61(12): 5923-5930, 2021 12 27.
Article in En | MEDLINE | ID: mdl-34843243
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Full text: 1 Database: MEDLINE Main subject: Receptors, G-Protein-Coupled / Lipids Type of study: Prognostic_studies Language: En Year: 2021 Type: Article
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Full text: 1 Database: MEDLINE Main subject: Receptors, G-Protein-Coupled / Lipids Type of study: Prognostic_studies Language: En Year: 2021 Type: Article