Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
6310986 | Chemosphere | 2013 | 4 Pages |
Abstract
⺠The CORAL software for the building up of QSPR/QSAR models is suggested. ⺠The SMILES is used as the representation of the molecular structure. ⺠The CORAL model for water solubility is described in detail.
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Authors
Andrey A. Toropov, Alla P. Toropova, Emilio Benfenati, Giuseppina Gini, Danuta Leszczynska, Jerzy Leszczynski,