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Predicting protein-ligand binding affinity and correcting crystal structures with quantum mechanical calculations: lactate dehydrogenase A.
Lukac, Iva; Abdelhakim, Hend; Ward, Richard A; St-Gallay, Stephen A; Madden, Judith C; Leach, Andrew G.
Afiliação
  • Lukac I; School of Pharmacy and Biomolecular Sciences , Liverpool John Moores University , Byrom Street , Liverpool , L3 3AF , UK . Email: a.g.leach@ljmu.ac.uk.
  • Abdelhakim H; School of Pharmacy and Biomolecular Sciences , Liverpool John Moores University , Byrom Street , Liverpool , L3 3AF , UK . Email: a.g.leach@ljmu.ac.uk.
  • Ward RA; Chemistry, Oncology, IMED Biotech Unit , AstraZeneca , Cambridge , UK.
  • St-Gallay SA; Sygnature Discovery Ltd , Bio City, Pennyfoot St , Nottingham , NG1 1GF , UK.
  • Madden JC; School of Pharmacy and Biomolecular Sciences , Liverpool John Moores University , Byrom Street , Liverpool , L3 3AF , UK . Email: a.g.leach@ljmu.ac.uk.
  • Leach AG; School of Pharmacy and Biomolecular Sciences , Liverpool John Moores University , Byrom Street , Liverpool , L3 3AF , UK . Email: a.g.leach@ljmu.ac.uk.
Chem Sci ; 10(7): 2218-2227, 2019 Feb 21.
Article em En | MEDLINE | ID: mdl-30881647

Texto completo: 1 Base de dados: MEDLINE Tipo de estudo: Prognostic_studies / Risk_factors_studies Idioma: En Ano de publicação: 2019 Tipo de documento: Article

Texto completo: 1 Base de dados: MEDLINE Tipo de estudo: Prognostic_studies / Risk_factors_studies Idioma: En Ano de publicação: 2019 Tipo de documento: Article