A general and expedient method for the solid-phase synthesis of 1, 4-benzodiazepine derivatives BA Bunin, JA Ellman Journal of the American Chemical Society 114 (27), 10997-10998, 1992 | 752 | 1992 |
The combinatorial synthesis and chemical and biological evaluation of a 1, 4-benzodiazepine library. BA Bunin, MJ Plunkett, JA Ellman Proceedings of the National Academy of Sciences 91 (11), 4708-4712, 1994 | 484 | 1994 |
The combinatorial index BA Bunin Elsevier, 1998 | 397 | 1998 |
Novel web-based tools combining chemistry informatics, biology and social networks for drug discovery M Hohman, K Gregory, K Chibale, PJ Smith, S Ekins, B Bunin Drug discovery today 14 (5-6), 261-270, 2009 | 162 | 2009 |
Bayesian models leveraging bioactivity and cytotoxicity information for drug discovery S Ekins, RC Reynolds, H Kim, MS Koo, M Ekonomidis, M Talaue, ... Chemistry & biology 20 (3), 370-378, 2013 | 106 | 2013 |
Using open source computational tools for predicting human metabolic stability and additional absorption, distribution, metabolism, excretion, and toxicity properties RR Gupta, EM Gifford, T Liston, CL Waller, M Hohman, BA Bunin, S Ekins Drug Metabolism and Disposition 38 (11), 2083-2090, 2010 | 103 | 2010 |
Chemoinformatics theory BA Bunin, B Siesel, GA Morales, J Bajorath Chemoinformatics: Theory, Practice, & Products, 1-49, 2007 | 94 | 2007 |
A collaborative database and computational models for tuberculosis drug discovery S Ekins, J Bradford, K Dole, A Spektor, K Gregory, D Blondeau, ... Molecular BioSystems 6 (5), 840-851, 2010 | 91 | 2010 |
Machine Learning Models and Pathway Genome Data Base for Trypanosoma cruzi Drug Discovery S Ekins, J Lage de Siqueira-Neto, LI McCall, M Sarker, M Yadav, ... PLoS neglected tropical diseases 9 (6), e0003878, 2015 | 86 | 2015 |
Compounds for enzyme inhibition MS Smyth, GJ Laidig, RT Borchardt, BA Bunin, CM Crews, JH Musser US Patent 7,232,818, 2007 | 84 | 2007 |
Analysis and hit filtering of a very large library of compounds screened against Mycobacterium tuberculosis S Ekins, T Kaneko, CA Lipinski, J Bradford, K Dole, A Spektor, K Gregory, ... Molecular bioSystems 6 (11), 2316-2324, 2010 | 82 | 2010 |
Enhancing hit identification in Mycobacterium tuberculosis drug discovery using validated dual-event Bayesian models S Ekins, RC Reynolds, SG Franzblau, B Wan, JS Freundlich, BA Bunin PloS one 8 (5), e63240, 2013 | 59 | 2013 |
Non Nucleic Acid Inhibitors of Protein⊙ DNA Interactions Identified through Combinatorial Chemistry SY Stevens, BA Bunin, MJ Plunkett, PC Swanson, JA Ellman, GD Glick Journal of the American Chemical Society 118 (43), 10650-10651, 1996 | 58 | 1996 |
Compounds for enzyme inhibition MS Smyth, GJ Laidig, RT Borchardt, BA Bunin, CM Crews, JH Musser, ... US Patent 8,088,741, 2012 | 53 | 2012 |
Ten simple rules for cultivating open science and collaborative R&D H Masum, A Rao, BM Good, MH Todd, AM Edwards, L Chan, BA Bunin, ... PLoS computational biology 9 (9), e1003244, 2013 | 49 | 2013 |
Application of combinatorial and parallel synthesis to medicinal chemistry BA Bunin, JM Dener, DA Livingston Annual reports in medicinal chemistry 34, 267-286, 1999 | 48 | 1999 |
Compounds for enzyme inhibition MS Smyth, GJ Laidig, RT Borchardt, BA Bunin, CM Crews, JH Musser US Patent 7,491,704, 2009 | 44 | 2009 |
Bayesian models for screening and TB Mobile for target inference with Mycobacterium tuberculosis S Ekins, AC Casey, D Roberts, T Parish, BA Bunin Tuberculosis 94 (2), 162-169, 2014 | 43 | 2014 |
Chemistry resource database B Bunin US Patent App. 09/825,135, 2002 | 41 | 2002 |
Compounds for enzyme inhibition MS Smyth, GJ Laidig, RT Borchardt, BA Bunin, CM Crews, JH Musser US Patent 8,129,346, 2012 | 40 | 2012 |