| Prediction of the biological activity spectra of organic compounds using the PASS online web resource DA Filimonov, AA Lagunin, TA Gloriozova, AV Rudik, DS Druzhilovskii, ... Chemistry of Heterocyclic Compounds 50, 444-457, 2014 | 985 | 2014 |
| PASS: prediction of activity spectra for biologically active substances A Lagunin, A Stepanchikova, D Filimonov, V Poroikov Bioinformatics 16 (8), 747-748, 2000 | 982 | 2000 |
| QSAR modelling of rat acute toxicity on the basis of PASS prediction A Lagunin, A Zakharov, D Filimonov, V Poroikov Molecular informatics 30 (2‐3), 241-250, 2011 | 458 | 2011 |
| Robustness of biological activity spectra predicting by computer program PASS for noncongeneric sets of chemical compounds VV Poroikov, DA Filimonov, YV Borodina, AA Lagunin, A Kos Journal of chemical information and computer sciences 40 (6), 1349-1355, 2000 | 376 | 2000 |
| PASS biological activity spectrum predictions in the enhanced open NCI database browser VV Poroikov, DA Filimonov, WD Ihlenfeldt, TA Gloriozova, AA Lagunin, ... Journal of chemical information and computer sciences 43 (1), 228-236, 2003 | 297 | 2003 |
| Computer-aided discovery of anti-inflammatory thiazolidinones with dual cyclooxygenase/lipoxygenase inhibition AA Geronikaki, AA Lagunin, DI Hadjipavlou-Litina, PT Eleftheriou, ... Journal of medicinal chemistry 51 (6), 1601-1609, 2008 | 226 | 2008 |
| PASS-assisted exploration of new therapeutic potential of natural products RK Goel, D Singh, A Lagunin, V Poroikov Medicinal Chemistry Research 20, 1509-1514, 2011 | 223 | 2011 |
| Multi-targeted natural products evaluation based on biological activity prediction with PASS A Lagunin, D Filimonov, V Poroikov Current Pharmaceutical Design 16 (15), 1703-1717, 2010 | 193 | 2010 |
| Prediction of biological activity spectra for substances: Evaluation on the diverse sets of drug-like structures AV Stepanchikova, AA Lagunin, DA Filimonov, VV Poroikov Current medicinal chemistry 10 (3), 225-233, 2003 | 188 | 2003 |
| Design, synthesis, computational and biological evaluation of new anxiolytics A Geronikaki, E Babaev, J Dearden, W Dehaen, D Filimonov, I Galaeva, ... Bioorganic & medicinal chemistry 12 (24), 6559-6568, 2004 | 167 | 2004 |
| CLC-Pred: A freely available web-service for in silico prediction of human cell line cytotoxicity for drug-like compounds AA Lagunin, VI Dubovskaja, AV Rudik, PV Pogodin, DS Druzhilovskiy, ... PloS one 13 (1), e0191838, 2018 | 156 | 2018 |
| Chemo-and bioinformatics resources for in silico drug discovery from medicinal plants beyond their traditional use: a critical review AA Lagunin, RK Goel, DY Gawande, P Pahwa, TA Gloriozova, ... Natural product reports 31 (11), 1585-1611, 2014 | 153 | 2014 |
| QNA-based ‘Star Track’QSAR approach DA Filimonov, AV Zakharov, AA Lagunin, VV Poroikov SAR and QSAR in Environmental Research 20 (7-8), 679-709, 2009 | 150 | 2009 |
| Computer-aided prediction of biological activity spectra for chemical compounds: opportunities and limitations DA Filimonov, DS Druzhilovskiy, AA Lagunin, TA Gloriozova, AV Rudik, ... Biomedical Chemistry: Research and Methods 1 (1), e00004-e00004, 2018 | 143 | 2018 |
| Collaborative development of predictive toxicology applications B Hardy, N Douglas, C Helma, M Rautenberg, N Jeliazkova, V Jeliazkov, ... Journal of cheminformatics 2 (1), 1-29, 2010 | 131 | 2010 |
| Quantitative prediction of antitarget interaction profiles for chemical compounds AV Zakharov, AA Lagunin, DA Filimonov, VV Poroikov Chemical Research in Toxicology 25 (11), 2378-2385, 2012 | 124 | 2012 |
| Предсказание спектров биологической активности органических соединений с помощью веб–ресурса PASS Online ДА Филимонов, АА Лагунин, ТА Глориозова, АВ Рудик, ... Химия гетероциклических соединений 3, 483-99, 2014 | 117 | 2014 |
| Design of new cognition enhancers: from computer prediction to synthesis and biological evaluation AA Geronikaki, JC Dearden, D Filimonov, I Galaeva, TL Garibova, ... Journal of medicinal chemistry 47 (11), 2870-2876, 2004 | 116 | 2004 |
| PASS: identification of probable targets and mechanisms of toxicity V Poroikov, D Filimonov, A Lagunin, T Gloriozova, A Zakharov SAR and QSAR in Environmental Research 18 (1-2), 101-110, 2007 | 114 | 2007 |
| SOMP: web server for in silico prediction of sites of metabolism for drug-like compounds A Rudik, A Dmitriev, A Lagunin, D Filimonov, V Poroikov Bioinformatics 31 (12), 2046-2048, 2015 | 113 | 2015 |
