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Journal of Chemical Information and Modeling|July 13, 2013
Localized heuristic inverse quantitative structure activity relationship with bulk descriptors using numerical gradientsJonna Stålring, Pedro R Almeida, Lars Carlsson, et al.
Idrugs : the Investigational Drugs Journal|March 9, 2006
Circular fingerprints: flexible molecular descriptors with applications from physical chemistry to ADMERobert C Glem, Andreas Bender, Catrin H Arnby, et al.
Journal of Chemical Information and Modeling|February 17, 2007
Reaction site mapping of xenobiotic biotransformationsScott Boyer, Catrin Hasselgren Arnby, Lars Carlsson, et al.
Plos Computational Biology|April 13, 2012
Automatic filtering and substantiation of drug safety signalsAnna Bauer-Mehren, Erik M van Mullingen, Paul Avillach, et al.
Journal of Chemical Information and Modeling|February 5, 2014
Assessment of machine learning reliability methods for quantifying the applicability domain of QSAR regression modelsMarko Toplak, Rok Močnik, Matija Polajnar, et al.
Journal of Environmental Management|March 8, 2005
Co-management: concepts and methodological implicationsLars Carlsson, Fikret Berkes
Alternatives to Laboratory Animals : ATLA|December 19, 2009
The use of computer models in pharmaceutical safety evaluationScott Boyer
Mutagenesis|December 13, 2018
Predicting Ames Mutagenicity Using Conformal Prediction in the Ames/QSAR International Challenge ProjectUlf Norinder, Ernst Ahlberg, Lars Carlsson
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