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SAR and QSAR in Environmental Research|June 21, 2002
The importance of hydrophobicity and electrophilicity descriptors in mechanistically-based QSARs for toxicological endpointsM T D Cronin, J C Dearden, J C Duffy, et al.
Toxicology in Vitro : an International Journal Published in Association with BIBRA|March 22, 2017
Automated workflows for modelling chemical fate, kinetics and toxicityJ V Sala Benito, Alicia Paini, Andrea-Nicole Richarz, et al.
Journal of Chemical Information and Modeling|January 26, 2005
Description of the electronic structure of organic chemicals using semiempirical and ab initio methods for development of toxicological QSARsTatiana I Netzeva, Aynur O Aptula, Emilio Benfenati, et al.
Environmental Science & Technology|June 8, 2026
MechoA+: A Chemical Structure Profiler Raising the Bar for the Prediction of Mechanisms of Toxic Action for Chemical Safety AssessmentGaspard Levet, Franklin J Bauer, Paul C Thomas, et al.
Advanced Drug Delivery Reviews|March 22, 2015
Ensuring confidence in predictions: A scheme to assess the scientific validity of in silico modelsMark Hewitt, Claire M Ellison, Mark T D Cronin, et al.
Chemosphere|December 20, 2002
Comparative assessment of methods to develop QSARs for the prediction of the toxicity of phenols to Tetrahymena pyriformisMark T D Cronin, Aynur O Aptula, Judith C Duffy, et al.
SAR and QSAR in Environmental Research|December 10, 2013
Evaluation criteria for the quality of published experimental data on nanomaterials and their usefulness for QSAR modellingL Lubinski, P Urbaszek, A Gajewicz, et al.
ALTEX|November 5, 2014
Read-across approaches--misconceptions, promises and challenges aheadGrace Patlewicz, Nicholas Ball, Richard A Becker, et al.
Environmental Science & Technology|January 22, 2021
Development of an Enhanced Mechanistically Driven Mode of Action Classification Scheme for Adverse Effects on Environmental SpeciesMaria Sapounidou, David J Ebbrell, Mark A Bonnell, et al.
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