Yu. V. Borodina

Robustness of Biological Activity Spectra Predicting by Computer Program PASS for Noncongeneric Sets of Chemical Compounds

Vladimir Poroikov, Dmitry Filimonov, Yu. V. Borodina et al. · Journal of Chemical Information and Computer Sciences · 2000 · 250 citations

Noncongeneric Sets, Drug Target, Engineering +31

PASS Biological Activity Spectrum Predictions in the Enhanced Open NCI Database Browser

Vladimir Poroikov, Wolf‐Dietrich Ihlenfeldt, Tatyana A. Gloriozova et al. · Journal of Chemical Information and Computer Sciences · 2002 · 233 citations

Engineering, Hit Identification, Activity Spectra +24

Chemical Similarity Assessment through Multilevel Neighborhoods of Atoms:  Definition and Comparison with the Other Descriptors

Vladimir Poroikov, Yu. V. Borodina, Tatyana A. Gloriozova · Journal of Chemical Information and Computer Sciences · 1999 · 193 citations

Bioorganic Chemistry, Engineering, Chemical Analysis +23

PDB Ligand Conformational Energies Calculated Quantum-Mechanically

Markus Sitzmann, Iwona E. Weidlich, Igor Filippov et al. · Journal of Chemical Information and Modeling · 2012 · 63 citations · Full text

Ligand Expo Database, Engineering, Conformational Energies +13

Predicting Biotransformation Potential from Molecular Structure

Yu. V. Borodina, A. Sadym, Dmitry Filimonov et al. · Journal of Chemical Information and Computer Sciences · 2003 · 42 citations

Engineering, Biomolecular Structure Prediction, Metabolomic Profiling +18