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• W2050273205 abstract "An overview is given on the diverse uses of computational chemistry in drug discovery. Particular emphasis is placed on virtual screening, de novo design, evaluation of drug-likeness, and advanced methods for determining protein-ligand binding." @default.
• W2050273205 created "2016-06-24" @default.
• W2050273205 creator A5053850265 @default.
• W2050273205 date "2004-03-19" @default.
• W2050273205 modified "2023-10-18" @default.
• W2050273205 title "The Many Roles of Computation in Drug Discovery" @default.
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• W2050273205 doi "https://doi.org/10.1126/science.1096361" @default.
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