Collaborative development of predictive toxicology applications B Hardy, N Douglas, C Helma, M Rautenberg, N Jeliazkova, V Jeliazkov, ... Journal of cheminformatics 2 (1), 7, 2010 | 130 | 2010 |
SAVI, in silico generation of billions of easily synthesizable compounds through expert-system type rules H Patel, WD Ihlenfeldt, PN Judson, YS Moroz, Y Pevzner, ML Peach, ... Scientific Data 7 (1), 1-14, 2020 | 52* | 2020 |
PyWATER: a PyMOL plug-in to find conserved water molecules in proteins by clustering H Patel, BA Grüning, S Günther, I Merfort Bioinformatics 30 (20), 2978-2980, 2014 | 46 | 2014 |
Toward a Comprehensive Treatment of Tautomerism in Chemoinformatics Including in InChI V2 DK Dhaked, WD Ihlenfeldt, H Patel, V Delannée, MC Nicklaus Journal of Chemical Information and Modeling 60 (3), 1253-1275, 2020 | 30 | 2020 |
Target Fishing by Cross‐Docking to Explain Polypharmacological Effects H Patel, X Lucas, I Bendik, S Günther, I Merfort ChemMedChem 10 (7), 1209-1217, 2015 | 25 | 2015 |
Mining and evaluation of molecular relationships in literature C Senger, BA Grüning, A Erxleben, K Döring, H Patel, S Flemming, ... Bioinformatics 28 (5), 709-714, 2012 | 17 | 2012 |
Adapting CHMTRN (CHeMistry TRaNslator) for a New Use PN Judson, WD Ihlenfeldt, H Patel, V Delannée, N Tarasova, MC Nicklaus Journal of Chemical Information and Modeling 60 (7), 3336-3341, 2020 | 12 | 2020 |
LeishBase: Leishmania major structural database S Kaur, H Patel, V Sharma, P Garg, N Roy IJIB 7 (2), 63-8, 2009 | 6 | 2009 |
PyGOLD: a python based API for docking based virtual screening workflow generation H Patel, T Brinkjost, O Koch Bioinformatics 33 (16), 2589-2590, 2017 | 4 | 2017 |
11th German Conference on Chemoinformatics (GCC 2015) U Fechner, C de Graaf, AE Torda, S Güssregen, A Evers, H Matter, ... Journal of cheminformatics 8 (1), 1-27, 2016 | 2 | 2016 |
Analysis of billions of Synthetically Accessible Virtual Inventory (SAVI) compounds as to their drug potential H Patel, WD Ihlenfeldt, M Nicklaus ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 257, 2019 | 1 | 2019 |
Synthetically Accessible Virtual Inventory (SAVI)-Next version: Toward more needles and less haystack H Patel, Y Pevzner, WD Ihlenfeldt, M Nicklaus ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 255, 2018 | | 2018 |
Chemical databases and other open-chemistry resources provided by the NCI CADD Group H Patel, Y Pevzner, DK Dhaked, M Peach, M Nicklaus ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 254, 2017 | | 2017 |
首页» 文章» 文章详细信息 B Hardy, N Douglas, C Helma, M Rautenberg, N Jeliazkova, V Jeliazkov, ... Journal of Cheminformatics 2 (1), 2010 | | 2010 |
Use and development of chem-bioinformatics tools and methods for drug discovery and target identification H Patel Dissertation, Universität Freiburg, 2014, 0 | | |