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Devoloppement of new in-silico screening methods in chemogenomics
Chemoinformatics and bioinformatics methods are now necessary in every drug discovery program. Pharmaceutical industries dedicate more than 10% of their research and... -
Mathematical Expressions for Estimation of Errors in the Formulas which are u...
International audience -
Structure-activity relationships for metabolism and toxicity
Predict in advance which compounds will be toxic in humans or not is a real challenge in the pharmaceutical world. Indeed, the mechanisms responsible for toxicity are... -
Homology model of the rainbow trout estrogen receptor (rtERalpha) and docking...
A model for rainbow trout (Oncorhynchus mykiss) estrogen receptor (rtERa) was built by homology with the human estrogen receptor (hERa). A high level of sequence... -
Quantitative structure-activity relationship to predict acute fish toxicity o...
International audience -
Synthesis and structure-activity relationship study of substituted caffeatees...
International audience -
Substance-tailored testing strategies in toxicology : an in silico methodolog...
International audience -
PLS-QSAR of the adult and developmental toxicity of chemicals to Hydra attenuata
International audience -
An evaluation of the predictive ability of the (Q)SAR software packages DEREK...
International audience -
Maximum-likelihood estimation of predictive uncertainty in probabilistic QSAR...
International audience -
Androgen receptor binding affinity : a QSAR evaluation
International audience -
Evaluation of the OECD (Q)SAR application toolbox for the profiling of estrog...
International audience -
Modelling structure activity landscapes with cliffs : a kernel regression-bas...
International audience -
Applying quantitative structure-activity relationship approaches to nanotoxic...
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e-Endocrine disrupting chemical databases for deriving SAR ans QSAR models
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Structure-activity modeling of a diverse set of androgen receptor ligands
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Uncertainty analysis in QSAR modeling and hazard assessment
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Integrated testing strategies and decision-making
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QSPR prediction of explosibility properties of chemical substances within the...
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