Considerations and recent advances in QSAR models for cytochrome P450-mediated drug metabolism prediction. - Wikidata - wikimedia - TriplyDB

Considerations and recent advances in QSAR models for cytochrome P450-mediated drug metabolism prediction.

Considerations and recent advances in QSAR models for cytochrome P450-mediated drug metabolism prediction.

http://www.wikidata.org/entity/Q37198661

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Computational prediction of metabolism: sites, products, SAR, P450 enzyme dynamics, and mechanisms Potentially increasing the metabolic stability of drug candidates via computational site of metabolism prediction by CYP2C9: The utility of incorporating protein flexibility via an ensemble of structures Advances in computational methods to predict the biological activity of compounds.In Silico Prediction of Cytochrome P450-Drug Interaction: QSARs for CYP3A4 and CYP2C9 QSAR of cytochrome inhibitors.Predictive tools for the evaluation of microbial effects on drugs during gastrointestinal passage.Insights on cytochrome p450 enzymes and inhibitors obtained through QSAR studies.Comprehensive and Automated Linear Interaction Energy Based Binding-Affinity Prediction for Multifarious Cytochrome P450 Aromatase Inhibitors Site of metabolism prediction for oxidation reactions mediated by oxidoreductases based on chemical bond.Drug Metabolism in Preclinical Drug Development: A Survey of the Discovery Process, Toxicology, and Computational Tools.New QSAR Models for Human Cytochromes P450, 1A2, 2D6 and 3A4 Implicated in the Metabolism of Drugs. Relevance of Dataset on Model Development.The Correlation between Chemical Structures and Antioxidant, Prooxidant, and Antitrypanosomatid Properties of Flavonoids.QSARs for PBPK modelling of environmental contaminants.Prediction of Effective Drug Combinations by an Improved Naïve Bayesian Algorithm.

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Considerations and recent advances in QSAR models for cytochrome P450-mediated drug metabolism prediction.

http://www.wikidata.org/entity/Q37198661

description

article científic

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article scientifique

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articolo scientifico

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artigo científico

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bilimsel makale

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scientific article published on 24 June 2008

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vedecký článok

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vetenskaplig artikel

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videnskabelig artikel

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vědecký článek

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name

Considerations and recent adva ...... ed drug metabolism prediction.

@en

Considerations and recent adva ...... ed drug metabolism prediction.

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type

label

Considerations and recent adva ...... ed drug metabolism prediction.

@en

Considerations and recent adva ...... ed drug metabolism prediction.

@nl

prefLabel

Considerations and recent adva ...... ed drug metabolism prediction.

@en

Considerations and recent adva ...... ed drug metabolism prediction.

@nl

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Journal of Computer - Aided Molecular Design

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Considerations and recent adva ...... ed drug metabolism prediction.

@en

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Haiyan Li

http://www.w3.org/2001/XMLSchema#string

Jin Sun

http://www.w3.org/2001/XMLSchema#string

Lan Zhang

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Xiaofan Sui

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Xiaowen Fan

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Yongjun Wang

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Zhonggui He

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P2860

Methods for reliability and uncertainty assessment and for applicability evaluations of classification- and regression-based QSARs

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Pharmacophore modeling and three-dimensional database searching for drug design using catalyst.

Use of robust classification techniques for the prediction of human cytochrome P450 2D6 inhibition.

Feature selection for descriptor based classification models. 2. Human intestinal absorption (HIA).

Comparative assessment of multiresponse regression methods for predicting the mechanisms of toxic action of phenols.

Modeling the toxicity of aromatic compounds to tetrahymena pyriformis: the response surface methodology with nonlinear methods.

On combining recursive partitioning and simulated annealing to detect groups of biologically active compounds.

A novel method for building regression tree models for QSAR based on artificial ant colony systems.

Prediction of P-glycoprotein substrates by a support vector machine approach.

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s10822-008-9225-4

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843-855

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scholarly article

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10.1007/S10822-008-9225-4

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11

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18574695

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