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| Laboratoire
d'Infochimie UMR 7177, ULP, STRASBOURG |
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Predictor of the aqueous solubility (logS) and the octanol/water partition coefficient (logP) for organic molecules using QSPR models involving fragment descriptors. |
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Two versions (both compatible with mol and SD files) are available: a Windows version with graphical interface and user-friendly tools, and a Linux version with command line only and batch mode. |
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To download a demo of ISIDA-logPS, please contact Pr. Alexandre VARNEK. |
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