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Journal of the American Chemical Society

Volumn 123, Issue 26, 2001, Pages 6246-6252

Calculation of relative binding free energy differences for fructose 1,6-bisphosphatase inhibitors using the thermodynamic cycle perturbation approach

(2) Reddy, M R a Erion, M D a

a Metabasis Therapeutics Inc (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; DRUG PRODUCTS; FREE ENERGY; LIQUIDS; MOLECULAR DYNAMICS; PROTEINS; SYNTHESIS (CHEMICAL); X RAY ANALYSIS;

MOLECULAR DESIGN;

FRUCTOSE;

5 AMINOIMIDAZOLE 4 CARBOXAMIDE 1 BETA DEXTRO RIBOFURANOSYL 5' MONOPHOSPHATE; ADENOSINE PHOSPHATE; ENZYME INHIBITOR; FRUCTOSE 1,6 BISPHOSPHATASE INHIBITOR; LIGAND; NUCLEOSIDE MONOPHOSPHATE KINASE; PHOSPHORIBOSYLAMINOIMIDAZOLECARBOXAMIDE FORMYLTRANSFERASE; UNCLASSIFIED DRUG;

ARTICLE; BINDING AFFINITY; CALCULATION; COMPUTER SYSTEM; CRYSTALLOGRAPHY; DRUG DESIGN; ENERGY; LIGAND BINDING; MOLECULAR DYNAMICS; PROTEIN INTERACTION; SOLVATION; SYNTHESIS; THERMODYNAMICS;

EID: 0034801307 PISSN: 00027863 EISSN: None Source Type: Journal
DOI: 10.1021/ja0103288 Document Type: Article

Times cited : (82)

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