CAESAR models for developmental toxicity A Cassano, A Manganaro, T Martin, D Young, N Piclin, M Pintore, ... Chemistry Central Journal 4, 1-11, 2010 | 996 | 2010 |
Does rational selection of training and test sets improve the outcome of QSAR modeling? TM Martin, P Harten, DM Young, EN Muratov, A Golbraikh, H Zhu, ... Journal of chemical information and modeling 52 (10), 2570-2578, 2012 | 304 | 2012 |
Quantitative structure− activity relationship modeling of rat acute toxicity by oral exposure H Zhu, TM Martin, L Ye, A Sedykh, DM Young, A Tropsha Chemical research in toxicology 22 (12), 1913-1921, 2009 | 268 | 2009 |
Applicability domains for classification problems: benchmarking of distance to models for Ames mutagenicity set I Sushko, S Novotarskyi, R Körner, AK Pandey, A Cherkasov, J Li, ... Journal of chemical information and modeling 50 (12), 2094-2111, 2010 | 253 | 2010 |
The next generation blueprint of computational toxicology at the US Environmental Protection Agency RS Thomas, T Bahadori, TJ Buckley, J Cowden, C Deisenroth, ... Toxicological Sciences 169 (2), 317-332, 2019 | 244 | 2019 |
Are the chemical structures in your QSAR correct? D Young, T Martin, R Venkatapathy, P Harten QSAR & combinatorial science 27 (11‐12), 1337-1345, 2008 | 225 | 2008 |
Prediction of the Acute Toxicity (96-h LC50) of Organic Compounds to the Fathead Minnow (Pimephales promelas) Using a Group Contribution Method TM Martin, DM Young Chemical Research in Toxicology 14 (10), 1378-1385, 2001 | 191 | 2001 |
CoMPARA: collaborative modeling project for androgen receptor activity K Mansouri, N Kleinstreuer, AM Abdelaziz, D Alberga, VM Alves, ... Environmental Health Perspectives 128 (2), 027002, 2020 | 138 | 2020 |
Predictive models for carcinogenicity and mutagenicity: frameworks, state-of-the-art, and perspectives E Benfenati, R Benigni, DM Demarini, C Helma, D Kirkland, TM Martin, ... Journal of Environmental Science and Health Part C 27 (2), 57-90, 2009 | 122 | 2009 |
MOAtox: A comprehensive mode of action and acute aquatic toxicity database for predictive model development MG Barron, CR Lilavois, TM Martin Aquatic Toxicology 161, 102-107, 2015 | 109 | 2015 |
A hierarchical clustering methodology for the estimation of toxicity TM Martin, P Harten, R Venkatapathy, S Das, DM Young Toxicology Mechanisms and Methods 18 (2-3), 251-266, 2008 | 107 | 2008 |
Comparison of in silico models for prediction of mutagenicity NG Bakhtyari, G Raitano, E Benfenati, T Martin, D Young Journal of Environmental Science and Health, Part C 31 (1), 45-66, 2013 | 98 | 2013 |
Toxicity estimation software tool (TEST) T Martin US Environmental Protection Agency, Washington DC, 2016-05, 2016 | 89* | 2016 |
CATMoS: collaborative acute toxicity modeling suite K Mansouri, AL Karmaus, J Fitzpatrick, G Patlewicz, P Pradeep, D Alberga, ... Environmental health perspectives 129 (4), 047013, 2021 | 84 | 2021 |
Measurements and modeling of cloud point behavior for polypropylene/n-pentane and polypropylene/n-pentane/carbon dioxide mixtures at high pressure TM Martin, AA Lateef, CB Roberts Fluid phase equilibria 154 (2), 241-259, 1999 | 41 | 1999 |
Mode of action classifications in the EnviroTox Database: Development and implementation of a consensus MOA classification A Kienzler, KA Connors, M Bonnell, MG Barron, A Beasley, CG Inglis, ... Environmental toxicology and chemistry 38 (10), 2294-2304, 2019 | 39 | 2019 |
Prediction of aquatic toxicity mode of action using linear discriminant and random forest models TM Martin, CM Grulke, DM Young, CL Russom, NY Wang, CR Jackson, ... Journal of chemical information and modeling 53 (9), 2229-2239, 2013 | 37 | 2013 |
Using toxicological evidence from QSAR models in practice E Benfenati, S Pardoe, T Martin, RG Diaza, A Lombardo, A Manganaro, ... ALTEX-Alternatives to animal experimentation 30 (1), 19-40, 2013 | 36 | 2013 |
Comparison of global and mode of action-based models for aquatic toxicity TM Martin, DM Young, CR Lilavois, MG Barron SAR and QSAR in Environmental Research 26 (3), 245-262, 2015 | 35 | 2015 |
Developing innovative treatment technologies for PFAS-containing wastes C Berg, B Crone, B Gullett, M Higuchi, MJ Krause, PM Lemieux, T Martin, ... Journal of the Air & Waste Management Association 72 (6), 540-555, 2022 | 34 | 2022 |