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CoMFA module within Sybyl, Tripos, St. Louis, MO
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CoMFA module within Sybyl, Tripos, St. Louis, MO.
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I-Set: Twenty substituted naphthalenes (-log activity values 2.8-7.0) overlayed using a template paradigm. Activities were adjusted to optimize the CoMFA model using Gasteiger/Hückel charges
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I-Set: Twenty substituted naphthalenes (-log activity values 2.8-7.0) overlayed using a template paradigm. Activities were adjusted to optimize the CoMFA model using Gasteiger/Hückel charges.
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