ENG KOI WIN

Neural networks in QSAR

Architecture of the Neural Device for direct QSAR:

Example - Neural Device in application to the propane molecule:

Neural Device

Main co-workers:

Dr. I. I. Baskin, Dr. V. A. Palyulin, Prof. N. S. Zefirov.

Literature:

  1. Baskin I. I., Palyulin V. A., Zefirov N. S., A neural device for searching direct correlations between structures and properties of chemical compounds. Journal of Chemical Information and Computer Science, 1997, 37, (4), 715-721.


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