Rational combinatorial library design. 3. Simulated annealing guided evaluation (SAGE) of molecular diversity: a novel computational tool for universal library design and database mining. |
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Authors: | W Zheng S J Cho C L Waller A Tropsha |
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Affiliation: | Laboratory for Molecular Modeling, School of Pharmacy, University of North Carolina at Chapel Hill 27599-7360, USA. |
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