Computational methods in drug discovery G Sliwoski, S Kothiwale, J Meiler, EW Lowe Jr, EL Barker Pharmacological reviews 66 (1), 334-395, 2014 | 2390 | 2014 |
Antidiabetic Properties of Azardiracta indica and Bougainvillea spectabilis: In Vivo Studies in Murine Diabetes Model M Bhat, SK Kothiwale, AR Tirmale, SY Bhargava, BN Joshi Evidence‐based Complementary and Alternative Medicine 2011 (1), 561625, 2011 | 156 | 2011 |
BCL::Conf: small molecule conformational sampling using a knowledge based rotamer library S Kothiwale, JL Mendenhall, J Meiler Journal of cheminformatics 7, 1-15, 2015 | 133 | 2015 |
Discoidin domain receptor 1 (DDR1) kinase as target for structure-based drug discovery S Kothiwale, CM Borza, EW Lowe Jr, A Pozzi, J Meiler Drug discovery today 20 (2), 255-261, 2015 | 88 | 2015 |
Comparative evaluation of spectroscopic models using different multivariate statistical tools in a multicancer scenario AD Ghanate, S Kothiwale, SP Singh, D Bertrand, CM Krishna Journal of Biomedical Optics 16 (2), 025003-025003-9, 2011 | 80 | 2011 |
External validation of the Oakland score to assess safe hospital discharge among adult patients with acute lower gastrointestinal bleeding in the US K Oakland, S Kothiwale, T Forehand, E Jackson, C Bucknall, MSL Sey, ... JAMA network open 3 (7), e209630-e209630, 2020 | 59 | 2020 |
BCL:: Conf: improved open-source knowledge-based conformation sampling using the crystallography open database J Mendenhall, BP Brown, S Kothiwale, J Meiler Journal of chemical information and modeling 61 (1), 189-201, 2020 | 35 | 2020 |
Antidiabetic properties of Azardiracta indica and Bougainvillea spectabilis M Bhat, SK Kothiwale, AR Tirmale, SY Bhargava, BN Joshi vivo, 9-15, 2011 | 31 | 2011 |
Introduction to the BioChemical Library (BCL): An application-based open-source toolkit for integrated cheminformatics and machine learning in computer-aided drug discovery BP Brown, O Vu, AR Geanes, S Kothiwale, M Butkiewicz, EW Lowe Jr, ... Frontiers in pharmacology 13, 833099, 2022 | 20 | 2022 |
Quantitative structure–activity relationship modeling of kinase selectivity profiles S Kothiwale, C Borza, A Pozzi, J Meiler Molecules 22 (9), 1576, 2017 | 12 | 2017 |
A novel knowledge based conformation sampling algorithm and applications in drug discovery SK Kothiwale | 1 | 2016 |
Drugit: Crowd-sourcing molecular design of non-peptidic VHL binders T Scott, CAP Smethurst, Y Westermaier, M Mayer, P Greb, R Kousek, ... | | 2023 |
Mo1711 EXTERNAL VALIDATION OF THE OAKLAND SCORE IN 38,067 PATIENTS WITH ACUTE LOWER GASTROINTESTINAL BLEEDING K Oakland, S Kothiwale, E Jackson, C Bucknall, M Sey, S Singh, V Jairath, ... Gastrointestinal Endoscopy 91 (6), AB461, 2020 | | 2020 |
External validation of the Oakland score in 38,067 patients with acute lower gastrointestinal bleeding and extension of thresholds for safe discharge (accepted) PJB Oakland K, Kothiwale S, Forehand T, Jackson E, Bucknall C, Sey S, Singh ... JAMA network open, 2020 | | 2020 |
FolditDD: Crowdsourcing drug discovery S Combs, S Kothiwale, J Meiler, M Vieth ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 251, 2016 | | 2016 |
Knowledge based conformation sampling algorithms and its application in Foldit drug design game S Kothiwale, J Mendenhall, S Combs, J Meiler ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 249, 2015 | | 2015 |
BCL: Conf A knowledge based ligand flexibility algorithm and application in computational drug discovery like online drug design game Foldit SK Kothiwale, J Meiler, W Lowe ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 248, 2014 | | 2014 |