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Quantitative structure-activity relationship modelling of the carcinogenic risk of nitroso compounds using regression analysis and the TOPS-MODE approach
Authors:A.M. Helguera  G. Pérez-Machado  R.D. Combes
Affiliation:1. Department of Chemistry , Central University of Las Villas , Santa Clara, Villa Clara, Cuba;2. Molecular Simulation and Drug Design Group, Central University of Las Villas , Santa Clara, Villa Clara, Cuba;3. REQUIMTE, Chemistry Department, Faculty of Sciences , University of Porto , Porto, Portugal aliuskamhelguera@yahoo.es;5. Molecular Simulation and Drug Design Group, Central University of Las Villas , Santa Clara, Villa Clara, Cuba;6. Consultant, 25 Elton Close , Newark, NG24 3JY, UK
Abstract:
Keywords:nitroso compounds  TOPS MODE  rodent  QSAR  carcinogenicity  structural alerts
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