Validation of Toxtree and SciQSAR in silico predictive software using a publicly available benchmark mutagenicity database and their applicability for the qualification of impurities in pharmaceuticals-Reference-Cited by-同舟云学术

Validation of Toxtree and SciQSAR in silico predictive software using a publicly available benchmark mutagenicity database and their applicability for the qualification of impurities in pharmaceuticals

Published:2013-11 Issue:2 Volume:67 Page:285-293
ISSN:0273-2300
Container-title:Regulatory Toxicology and Pharmacology
language:en
Short-container-title:Regulatory Toxicology and Pharmacology

Author:

Contrera Joseph F.

Publisher

Elsevier BV

Subject

Toxicology,General Medicine

Reference31 articles.

1. The use of structure–activity relationship analysis in the food contact notification program;Bailey;Regul. Toxicol. Pharmacol.,2005

2. Structure alerts for carcinogenicity, and the Salmonella assay system: a novel insight through the chemical relational databases technology;Begnini;Mutat. Res.,2008

3. Structure–activity relationship studies of chemical mutagens and carcinogens: mechanistic investigations and prediction approaches;Benigni;Chem. Rev.,2005

4. In silico screening of chemicals for bacterial mutagenicity using electrotopological E-state indices and MDL® QSAR software;Contrera;Regul. Toxicol. Pharmacol.,2005

5. Comparison of MC4PC and MDL-QSAR rodent carcinogenicity predictiona and the enhancement of predictive performance by combining QSAR models;Contrera;Regul. Toxicol. Pharmacol.,2007

Cited by 23 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Mutagenic and genotoxic in silico QSAR prediction of dimer impurity of gliflozins; canagliflozin, dapaglifozin, and emphagliflozin and in vitro evaluation by Ames and micronucleus test;Drug and Chemical Toxicology;2024-07-29

2. In Silico Toxicological Protocols Optimization for the Prediction of Toxicity of Drugs;Biosystems, Biomedical & Drug Delivery Systems;2024

3. Machine Learning and Deep Learning Applications to Evaluate Mutagenicity;Machine Learning and Deep Learning in Computational Toxicology;2023

4. Structural Design and Synthesis of Novel Cyclic Peptide Inhibitors Targeting Mycobacterium tuberculosis Transcription;Life;2022-08-28

5. Insect kinin mimics act as potential control agents for aphids: Structural modifications of Trp ⁴;Journal of Peptide Science;2022-08-16