Igor I. Baskin

QSAR Modeling: Where Have You Been? Where Are You Going To?

Artem Cherkasov, Eugene Muratov, Denis Fourches et al. · Journal of Medicinal Chemistry · 2013 · 2.1K citations

Pharmacy, Medicinal Chemistry, Computational Chemistry +16

Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information

Iurii Sushko, Sergii Novotarskyi, Robert Körner et al. · Journal of Computer-Aided Molecular Design · 2011 · 687 citations · Full text

Pharmacy, Chemistry, Computational Chemistry +16

Applicability Domains for Classification Problems: Benchmarking of Distance to Models for Ames Mutagenicity Set

Iurii Sushko, Sergii Novotarskyi, Robert Körner et al. · Journal of Chemical Information and Modeling · 2010 · 259 citations · Full text

Pharmacy, Toxicology, Computational Biology +16

Machine Learning Methods for Property Prediction in Chemoinformatics:<i>Quo Vadis</i>?

Alexandre Varnek, Igor I. Baskin · Journal of Chemical Information and Modeling · 2012 · 242 citations

Pharmacy, Chemistry, Data Science +16

De Novo Molecular Design by Combining Deep Autoencoder Recurrent Neural Networks with Generative Topographic Mapping

Boris Sattarov, Igor I. Baskin, Dragos Horvath et al. · Journal of Chemical Information and Modeling · 2019 · 169 citations

Pharmacy, Medicinal Chemistry, Computational Medicinal Chemistry +16