Vladimir Poroikov
Vladimir Poroikov
Institute of Biomedical Chemistry
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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
PASS: prediction of activity spectra for biologically active substances
A Lagunin, A Stepanchikova, D Filimonov, V Poroikov
Bioinformatics 16 (8), 747-748, 2000
QSAR without borders
EN Muratov, J Bajorath, RP Sheridan, IV Tetko, D Filimonov, V Poroikov, ...
Chemical Society Reviews 49 (11), 3525-3564, 2020
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
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
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
Chemical similarity assessment through multilevel neighborhoods of atoms: definition and comparison with the other descriptors
D Filimonov, V Poroikov, Y Borodina, T Gloriozova
Journal of chemical information and computer sciences 39 (4), 666-670, 1999
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
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
Discriminating between drugs and nondrugs by prediction of activity spectra for substances (PASS)
S Anzali, G Barnickel, B Cezanne, M Krug, D Filimonov, V Poroikov
Journal of medicinal chemistry 44 (15), 2432-2437, 2001
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
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
How to acquire new biological activities in old compounds by computer prediction
VV Poroikov, DA Filimonov
Journal of computer-aided molecular design 16, 819-824, 2002
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
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
A critical overview of computational approaches employed for COVID-19 drug discovery
EN Muratov, R Amaro, CH Andrade, N Brown, S Ekins, D Fourches, ...
Chemical Society Reviews 50 (16), 9121-9151, 2021
Novel antitumor agents: marine sponge alkaloids, their synthetic analogs and derivatives
VM Dembitsky, TA Gloriozova, VV Poroikov
Mini reviews in medicinal chemistry 5 (3), 319-336, 2005
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
Cyclobutane-containing alkaloids: origin, synthesis, and biological activities
A Sergeiko, VV Poroikov, LO Hanuš, VM Dembitsky
The open medicinal chemistry journal 2, 26, 2008
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
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