Optical structure recognition software to recover chemical information: OSRA, an open source solution IV Filippov, MC Nicklaus Journal of chemical information and modeling 49 (3), 740-743, 2009 | 168 | 2009 |
Open data, open source and open standards in chemistry: the Blue Obelisk five years on NM O'boyle, R Guha, EL Willighagen, SE Adams, J Alvarsson, JC Bradley, ... Journal of cheminformatics 3, 1-15, 2011 | 97 | 2011 |
CLEF-IP 2010: Retrieval Experiments in the Intellectual Property Domain. F Piroi, M Lupu, A Hanbury, AP Sexton, W Magdy, IV Filippov CLEF (notebook papers/labs/workshops), 2010 | 92 | 2010 |
PROSIT: pseudo-rotational online service and interactive tool, applied to a conformational survey of nucleosides and nucleotides G Sun, JH Voigt, IV Filippov, VE Marquez, MC Nicklaus Journal of chemical information and computer sciences 44 (5), 1752-1762, 2004 | 71 | 2004 |
PDB ligand conformational energies calculated quantum-mechanically M Sitzmann, IE Weidlich, IV Filippov, C Liao, ML Peach, WD Ihlenfeldt, ... Journal of chemical information and modeling 52 (3), 739-756, 2012 | 69 | 2012 |
Internet resources integrating many small-molecule databases1 M Sitzmann, IV Filippov, MC Nicklaus SAR and QSAR in Environmental Research 19 (1-2), 1-9, 2008 | 47 | 2008 |
Computational tools and resources for metabolism-related property predictions. 2. Application to prediction of half-life time in human liver microsomes AV Zakharov, ML Peach, M Sitzmann, IV Filippov, HJ McCartney, ... Future medicinal chemistry 4 (15), 1933-1944, 2012 | 34 | 2012 |
Inhibitors for the hepatitis C virus RNA polymerase explored by SAR with advanced machine learning methods IE Weidlich, IV Filippov, J Brown, N Kaushik-Basu, R Krishnan, ... Bioorganic & medicinal chemistry 21 (11), 3127-3137, 2013 | 32 | 2013 |
Overview of the TREC 2011 Chemical IR Track. M Lupu, J Zhao, J Huang, H Gurulingappa, J Fluck, M Zimmermann, ... TREC, 2011 | 20 | 2011 |
Using the gini coefficient to measure the chemical diversity of small‐molecule libraries IE Weidlich, IV Filippov Journal of Computational Chemistry 37 (22), 2091-2097, 2016 | 12 | 2016 |
Extracting chemical structure information: Optical structure recognition application IV Filippov, MC Nicklaus Pre-Proceedings of the Eighth IAPR International Workshop on Graphics …, 2009 | 10 | 2009 |
Supersymmetry and DLCQ F Antonuccio, I Filippov, P Haney, O Lunin, S Pinsky, U Trittmann, J Hiller, ... Arxiv preprint hep-th/9910012, 1999 | 9 | 1999 |
Development and implementation of (Q) SAR modeling within the CHARMMing web‐user interface IE Weidlich, Y Pevzner, BT Miller, IV Filippov, HL Woodcock, BR Brooks Journal of computational chemistry 36 (1), 62-67, 2015 | 8 | 2015 |
Renormalizing DLCQ using supersymmetry I Filippov, S Pinsky, JR Hiller Physics Letters B 506 (1-2), 221-230, 2001 | 7 | 2001 |
Improvements in optical structure recognition application IV Filippov, MC Nicklaus, J Kinney Ninth IAPR International Workshop on. Document Analysis Systems Boston, MA, 2010 | 6 | 2010 |
Modern Approaches to Chemical Image Recognition IV Filippov, M Lupu, AP Sexton Current Challenges in Patent Information Retrieval, 369-389, 2017 | 5 | 2017 |
Using conformationally locked nucleosides to calibrate the anomeric effect: implications for glycosyl bond stability HR Moon, MA Siddiqui, G Sun, IV Filippov, NA Landsman, YC Lee, ... Tetrahedron 66 (34), 6707-6717, 2010 | 5 | 2010 |
Numerical simulations of -dimensional super Yang-Mills theory with large supersymmetry breaking I Filippov, S Pinsky Physical Review D 66 (2), 025012, 2002 | 2 | 2002 |
Risk Metrics to Measure Safety Performance of the National Airspace System: Implementation Using Machine Learning F Bati, F Lee, R Bollschweiler, L Withington, N Khorrami, I Filippov, ... 2021 IEEE/AIAA 40th Digital Avionics Systems Conference (DASC), 1-9, 2021 | 1 | 2021 |
Optical Structure Recognition Application Entry in Image2Structure Task. IV Filippov, D Katsubo, MC Nicklaus TREC, 2011 | 1 | 2011 |