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Page 1
Global QSAR models of skin sensitisers for regulatory purposes.
Chaudhry Q, Piclin N, Cotterill J, Pintore M, Price NR, Chrétien JR, Roncaglioni A. Chaudhry Q, et al. Among authors: roncaglioni a. Chem Cent J. 2010 Jul 29;4 Suppl 1(Suppl 1):S5. doi: 10.1186/1752-153X-4-S1-S5. Chem Cent J. 2010. PMID: 20678184 Free PMC article.
Evaluation of QSAR models for the prediction of ames genotoxicity: a retrospective exercise on the chemical substances registered under the EU REACH regulation.
Cassano A, Raitano G, Mombelli E, Fernández A, Cester J, Roncaglioni A, Benfenati E. Cassano A, et al. Among authors: roncaglioni a. J Environ Sci Health C Environ Carcinog Ecotoxicol Rev. 2014;32(3):273-98. doi: 10.1080/10590501.2014.938955. J Environ Sci Health C Environ Carcinog Ecotoxicol Rev. 2014. PMID: 25226221
A comparative survey of chemistry-driven in silico methods to identify hazardous substances under REACH.
Nendza M, Gabbert S, Kühne R, Lombardo A, Roncaglioni A, Benfenati E, Benigni R, Bossa C, Strempel S, Scheringer M, Fernández A, Rallo R, Giralt F, Dimitrov S, Mekenyan O, Bringezu F, Schüürmann G. Nendza M, et al. Among authors: roncaglioni a. Regul Toxicol Pharmacol. 2013 Aug;66(3):301-14. doi: 10.1016/j.yrtph.2013.05.007. Epub 2013 May 21. Regul Toxicol Pharmacol. 2013. PMID: 23707536
Identification of the structural requirements of the receptor-binding affinity of diphenolic azoles to estrogen receptors alpha and beta by three-dimensional quantitative structure-activity relationship and structure-activity relationship analysis.
Demyttenaere-Kovatcheva A, Cronin MT, Benfenati E, Roncaglioni A, Lopiparo E. Demyttenaere-Kovatcheva A, et al. Among authors: roncaglioni a. J Med Chem. 2005 Dec 1;48(24):7628-36. doi: 10.1021/jm050604j. J Med Chem. 2005. PMID: 16302803
New public QSAR model for carcinogenicity.
Fjodorova N, Vracko M, Novic M, Roncaglioni A, Benfenati E. Fjodorova N, et al. Among authors: roncaglioni a. Chem Cent J. 2010 Jul 29;4 Suppl 1(Suppl 1):S3. doi: 10.1186/1752-153X-4-S1-S3. Chem Cent J. 2010. PMID: 20678182 Free PMC article.
CoMPARA: Collaborative Modeling Project for Androgen Receptor Activity.
Mansouri K, Kleinstreuer N, Abdelaziz AM, Alberga D, Alves VM, Andersson PL, Andrade CH, Bai F, Balabin I, Ballabio D, Benfenati E, Bhhatarai B, Boyer S, Chen J, Consonni V, Farag S, Fourches D, García-Sosa AT, Gramatica P, Grisoni F, Grulke CM, Hong H, Horvath D, Hu X, Huang R, Jeliazkova N, Li J, Li X, Liu H, Manganelli S, Mangiatordi GF, Maran U, Marcou G, Martin T, Muratov E, Nguyen DT, Nicolotti O, Nikolov NG, Norinder U, Papa E, Petitjean M, Piir G, Pogodin P, Poroikov V, Qiao X, Richard AM, Roncaglioni A, Ruiz P, Rupakheti C, Sakkiah S, Sangion A, Schramm KW, Selvaraj C, Shah I, Sild S, Sun L, Taboureau O, Tang Y, Tetko IV, Todeschini R, Tong W, Trisciuzzi D, Tropsha A, Van Den Driessche G, Varnek A, Wang Z, Wedebye EB, Williams AJ, Xie H, Zakharov AV, Zheng Z, Judson RS. Mansouri K, et al. Among authors: roncaglioni a. Environ Health Perspect. 2020 Feb;128(2):27002. doi: 10.1289/EHP5580. Epub 2020 Feb 7. Environ Health Perspect. 2020. PMID: 32074470 Free PMC article.
91 results