标题
Index of Ideality of Correlation: new possibilities to validate QSAR: a case study
作者
关键词
Toxicity, Fathead minnow, Index of Ideality of Correlation, QSAR, Monte Carlo method, CORAL software
出版物
STRUCTURAL CHEMISTRY
Volume 29, Issue 1, Pages 33-38
出版商
Springer Nature
发表日期
2017-07-13
DOI
10.1007/s11224-017-0997-9
参考文献
相关参考文献
注意：仅列出部分参考文献，下载原文获取全部文献信息。- The index of ideality of correlation: A criterion of predictive potential of QSPR/QSAR models?
- (2017) Andrey A. Toropov et al. MUTATION RESEARCH-GENETIC TOXICOLOGY AND ENVIRONMENTAL MUTAGENESIS
- The index of ideality of correlation: A criterion of predictability of QSAR models for skin permeability?
- (2017) Alla P. Toropova et al. SCIENCE OF THE TOTAL ENVIRONMENT
- Prediction of gas chromatographic retention indices based on Monte Carlo method
- (2017) Aleksandar M. Veselinović et al. TALANTA
- Quasi-SMILES and nano-QFPR: The predictive model for zeta potentials of metal oxide nanoparticles
- (2016) Andrey A. Toropov et al. CHEMICAL PHYSICS LETTERS
- The Monte Carlo technique as a tool to predict LOAEL
- (2016) Jovana B. Veselinović et al. EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY
- Monte Carlo method for predicting of cardiac toxicity: hERG blocker compounds
- (2016) Marco Gobbi et al. TOXICOLOGY LETTERS
- QSAR modeling for predicting reproductive toxicity of chemicals in rats for regulatory purposes
- (2016) Nikita Basant et al. Toxicology Research
- QSAR model as a random event: A case of rat toxicity
- (2015) Alla P. Toropova et al. BIOORGANIC & MEDICINAL CHEMISTRY
- A similarity-based QSAR model for predicting acute toxicity towards the fathead minnow (Pimephales promelas)
- (2015) M. Cassotti et al. SAR AND QSAR IN ENVIRONMENTAL RESEARCH
- QSPR models for estimating retention in HPLC with the p solute polarity parameter based on the Monte Carlo method
- (2015) Aleksandar M. Veselinović et al. STRUCTURAL CHEMISTRY
- QSAR as a random event: a case of NOAEL
- (2014) Alla P. Toropova et al. ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH
- Multimolecular polyhedra and QSPR
- (2014) Ramon Carbó-Dorca JOURNAL OF MATHEMATICAL CHEMISTRY
- QSAR Study of H1N1 Neuraminidase Inhibitors from Influenza a Virus
- (2014) Apilak Worachartcheewan et al. Letters in Drug Design & Discovery
- QSAR as a random event: Modeling of nanoparticles uptake in PaCa2 cancer cells
- (2013) Andrey A. Toropov et al. CHEMOSPHERE
- Development and validation of theoretical linear solvation energy relationship models for toxicity prediction to fathead minnow (pimephales promelas)
- (2013) Felichesmi Lyakurwa et al. CHEMOSPHERE
- Predicting Concentrations of Organic Chemicals in Fish by Using Toxicokinetic Models
- (2012) Julita Stadnicka et al. ENVIRONMENTAL SCIENCE & TECHNOLOGY
- Notes on quantitative structure-property relationships (QSPR), part 3: Density functions origin shift as a source of quantum QSPR algorithms in molecular spaces
- (2012) Ramon Carbó-Dorca JOURNAL OF COMPUTATIONAL CHEMISTRY
- On further application of r m2 as a metric for validation of QSAR models
- (2009) Indrani Mitra et al. JOURNAL OF CHEMOMETRICS
Add your recorded webinar
Do you already have a recorded webinar? Grow your audience and get more views by easily listing your recording on Peeref.
Upload NowAsk a Question. Answer a Question.
Quickly pose questions to the entire community. Debate answers and get clarity on the most important issues facing researchers.
Get Started