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CATMoS: Collaborative Acute Toxicity Modeling Suite.
Mansouri K, Karmaus AL, Fitzpatrick J, Patlewicz G, Pradeep P, Alberga D, Alepee N, Allen TEH, Allen D, Alves VM, Andrade CH, Auernhammer TR, Ballabio D, Bell S, Benfenati E, Bhattacharya S, Bastos JV, Boyd S, Brown JB, Capuzzi SJ, Chushak Y, Ciallella H, Clark AM, Consonni V, Daga PR, Ekins S, Farag S, Fedorov M, Fourches D, Gadaleta D, Gao F, Gearhart JM, Goh G, Goodman JM, Grisoni F, Grulke CM, Hartung T, Hirn M, Karpov P, Korotcov A, Lavado GJ, Lawless M, Li X, Luechtefeld T, Lunghini F, Mangiatordi GF, Marcou G, Marsh D, Martin T, Mauri A, Muratov EN, Myatt GJ, Nguyen DT, Nicolotti O, Note R, Pande P, Parks AK, Peryea T, Polash AH, Rallo R, Roncaglioni A, Rowlands C, Ruiz P, Russo DP, Sayed A, Sayre R, Sheils T, Siegel C, Silva AC, Simeonov A, Sosnin S, Southall N, Strickland J, Tang Y, Teppen B, Tetko IV, Thomas D, Tkachenko V, Todeschini R, Toma C, Tripodi I, Trisciuzzi D, Tropsha A, Varnek A, Vukovic K, Wang Z, Wang L, Waters KM, Wedlake AJ, Wijeyesakere SJ, Wilson D, Xiao Z, Yang H, Zahoranszky-Kohalmi G, Zakharov AV, Zhang FF, Zhang Z, Zhao T, Zhu H, Zorn KM, Casey W, Kleinstreuer NC. Mansouri K, et al. Among authors: gadaleta d. Environ Health Perspect. 2021 Apr;129(4):47013. doi: 10.1289/EHP8495. Epub 2021 Apr 30. Environ Health Perspect. 2021. PMID: 33929906 Free PMC article.
Integration of QSAR models for bioconcentration suitable for REACH.
Gissi A, Nicolotti O, Carotti A, Gadaleta D, Lombardo A, Benfenati E. Gissi A, et al. Among authors: gadaleta d. Sci Total Environ. 2013 Jul 1;456-457:325-32. doi: 10.1016/j.scitotenv.2013.03.104. Epub 2013 Apr 24. Sci Total Environ. 2013. PMID: 23624006
REACH and in silico methods: an attractive opportunity for medicinal chemists.
Nicolotti O, Benfenati E, Carotti A, Gadaleta D, Gissi A, Mangiatordi GF, Novellino E. Nicolotti O, et al. Among authors: gadaleta d. Drug Discov Today. 2014 Nov;19(11):1757-1768. doi: 10.1016/j.drudis.2014.06.027. Epub 2014 Jul 3. Drug Discov Today. 2014. PMID: 24998783 Review.
CORAL: model for no observed adverse effect level (NOAEL).
Toropov AA, Toropova AP, Pizzo F, Lombardo A, Gadaleta D, Benfenati E. Toropov AA, et al. Among authors: gadaleta d. Mol Divers. 2015 Aug;19(3):563-75. doi: 10.1007/s11030-015-9587-1. Epub 2015 Apr 8. Mol Divers. 2015. PMID: 25850638 Free PMC article.
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