Molecular Field Topology Analysis Method in QSAR Studies of Organic Compounds. - Vladimir A. Palyulin; Eugene V. Radchenko; Nikolai S. Zefirov (J. Chem. Inf. Comput. Sci., 2000)

Virtual Computational Chemistry Laboratory - Design and Description. - Igor V. Tetko; Johann Gasteiger; Roberto Todeschini; Andrea Mauri 002; David J. Livingstone; Peter Ertl; Vladimir A. Palyulin; Eugene V. Radchenko; Nikolai S. Zefirov; Alexander S. Makarenko; Vsevolod Yu. Tanchuk; Volodymyr V. Prokopenko (J. Comput. Aided Mol. Des., 2005)

Ionotropic GABA receptors: modelling and design of selective ligands. - Vladimir A. Palyulin; Eugene V. Radchenko; Dmitry I. Osolodkin; Vladimir I. Chupakhin; Nikolai S. Zefirov (J. Cheminformatics, 2010)

Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information. - Iurii Sushko; Sergii Novotarskyi; Robert Körner; Anil Kumar Pandey; Matthias Rupp; Wolfram Teetz; Stefan Brandmaier; Ahmed Abdelaziz; Volodymyr V. Prokopenko; Vsevolod Yu. Tanchuk; Roberto Todeschini; Alexandre Varnek; et al. (J. Comput. Aided Mol. Des., 2011)

Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information. - Iurii Sushko; Anil Kumar Pandey; Sergii Novotarskyi; Robert Körner; Matthias Rupp; Wolfram Teetz; Stefan Brandmaier; Ahmed Abdelaziz; Volodymyr V. Prokopenko; Vsevolod Yu. Tanchuk; Roberto Todeschini; Alexandre Varnek; et al. (J. Cheminformatics, 2011)

Influence of Descriptor Implementation on Compound Ranking Based on Multiparameter Assessment. - Ekaterina A. Sosnina; Dmitry I. Osolodkin; Eugene V. Radchenko; Sergey B. Sosnin; Vladimir A. Palyulin (J. Chem. Inf. Model., 2018)

Time-Domain Analysis of Molecular Dynamics Trajectories Using Deep Neural Networks: Application to Activity Ranking of Tankyrase Inhibitors. - Vladimir P. Berishvili; Valentin O. Perkin; Andrew E. Voronkov; Eugene V. Radchenko; Riyaz Syed; Venkata Ramana Reddy Chittireddy; Viness Pillay; Pradeep Kumar 003; Yahya E. Choonara; Ahmed Kamal; Vladimir A. Palyulin (J. Chem. Inf. Model., 2019)