Correlation intensity index (CII) as a benchmark of predictive potential: Construction of quantitative structure activity relationship models for anti-influenza single-stranded DNA aptamers using Monte Carlo optimization

The index of ideality of correlation improves the predictive potential of models of the antioxidant activity of tripeptides from frog skin (Litoria rubella)

(2021) Alla P. Toropova et al.   COMPUTERS IN BIOLOGY AND MEDICINE

The using of the Index of Ideality of Correlation (IIC) to improve predictive potential of models of water solubility for pesticides

(2020) Alla P. Toropova et al.   ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH

QSAR models for biocides: The example of the prediction of Daphnia magna acute toxicity

(2020) M. Marzo et al.   SAR AND QSAR IN ENVIRONMENTAL RESEARCH

CORAL: QSAR models of CB1 cannabinoid receptor inhibitors based on local and global SMILES attributes with the index of ideality of correlation and the correlation contradiction index

(2020) Parvin Kumar et al.   CHEMOMETRICS AND INTELLIGENT LABORATORY SYSTEMS

Correlation intensity index: Building up models for mutagenicity of silver nanoparticles

(2020) Andrey A. Toropov et al.   SCIENCE OF THE TOTAL ENVIRONMENT

Construction of pioneering quantitative structure activity relationship screening models for abuse potential of designer drugs using index of ideality of correlation in monte carlo optimization

(2020) Ashwani Kumar et al.   ARCHIVES OF TOXICOLOGY

Fullerenes C60 and C70: a model for solubility by applying the correlation intensity index

(2020) Alla P. Toropova et al.   FULLERENES NANOTUBES AND CARBON NANOSTRUCTURES

“Ideal correlations” for the predictive toxicity to Tetrahymena pyriformis

(2020) Andrey A. Toropov et al.   TOXICOLOGY MECHANISMS AND METHODS

Correlation intensity index: mathematical modeling of cytotoxicity of metal oxide nanoparticles

(2020) Shahin Ahmadi et al.   Nanotoxicology

In silico enhancement of azo dye adsorption affinity for cellulose fibre through mechanistic interpretation under guidance of QSPR models using Monte Carlo method with index of ideality correlation

(2020) P. Kumar et al.   SAR AND QSAR IN ENVIRONMENTAL RESEARCH

Identification of good and bad fragments of tricyclic triazinone analogues as potential PKC-θ inhibitors through SMILES–based QSAR and molecular docking

(2020) Ashwani Kumar et al.   STRUCTURAL CHEMISTRY

Quantitative structure activity relationship studies of novel hydrazone derivatives as α-amylase inhibitors with index of ideality of correlation

(2020) Meenakshi Duhan et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Cytotoxicity of quantum dots: Use of quasiSMILES in development of reliable models with index of ideality of correlation and the consensus modelling

(2020) Ashwani Kumar et al.   JOURNAL OF HAZARDOUS MATERIALS

How the CORAL software can be used to select compounds for efficient treatment of neurodegenerative diseases?

(2020) Alla P. Toropova et al.   TOXICOLOGY AND APPLIED PHARMACOLOGY

Prediction of the binding affinity of aptamers against the influenza virus

(2019) X. Yu et al.   SAR AND QSAR IN ENVIRONMENTAL RESEARCH

Does the Index of Ideality of Correlation Detect the Better Model Correctly?

(2019) Alla P. Toropova et al.   Molecular Informatics

Influenza Hemagglutinin and Neuraminidase: Yin–Yang Proteins Coevolving to Thwart Immunity

(2019) Ivan Kosik et al.   Viruses-Basel

In silico design of diacylglycerol acyltransferase-1 (DGAT1) inhibitors based on SMILES descriptors using Monte-Carlo method

(2019) P. Kumar et al.   SAR AND QSAR IN ENVIRONMENTAL RESEARCH

Nucleobase sequence based building up of reliable QSAR models with the index of ideality correlation using Monte Carlo method

(2019) Parvin Kumar et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Is a Universal Influenza Virus Vaccine Possible?

(2019) Raffael Nachbagauer et al.   Annual Review of Medicine

Mathematical modeling of cytotoxicity of metal oxide nanoparticles using the index of ideality correlation criteria

(2019) Shahin Ahmadi   CHEMOSPHERE

Synthesis, molecular docking and QSAR study of thiazole clubbed pyrazole hybrid as α-amylase inhibitor

(2019) Meenakshi Duhan et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

The index of ideality of correlation: A statistical yardstick for better QSAR modeling of glucokinase activators

(2019) Manisha Nimbhal et al.   STRUCTURAL CHEMISTRY

Semi-correlations combined with the index of ideality of correlation: a tool to build up model of mutagenic potential

(2018) Alla P. Toropova et al.   MOLECULAR AND CELLULAR BIOCHEMISTRY

Predicting Cytotoxicity of 2-Phenylindole Derivatives Against Breast Cancer Cells Using Index of Ideality of Correlation

(2018) ANDREY A. TOROPOV et al.   ANTICANCER RESEARCH

Prediction of the adsorption coefficients of some aromatic compounds on multi-wall carbon nanotubes by the Monte Carlo method

(2018) S. Ahmadi et al.   SAR AND QSAR IN ENVIRONMENTAL RESEARCH

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

CORAL: Binary classifications (active/inactive) for drug-induced liver injury

(2017) Alla P. Toropova et al.   TOXICOLOGY LETTERS

Aptamer-based ‘point-of-care testing’

(2016) Subash C.B. Gopinath et al.   BIOTECHNOLOGY ADVANCES

Cross-Protection of Influenza A Virus Infection by a DNA Aptamer Targeting the PA Endonuclease Domain

(2015) Shuofeng Yuan et al.   ANTIMICROBIAL AGENTS AND CHEMOTHERAPY

Designing Anti-Influenza Aptamers: Novel Quantitative Structure Activity Relationship Approach Gives Insights into Aptamer – Virus Interaction

(2014) Boaz Musafia et al.   PLoS One

QSAR as a random event: Modeling of nanoparticles uptake in PaCa2 cancer cells

(2013) Andrey A. Toropov et al.   CHEMOSPHERE

Comparative QSARs for antimalarial endochins: Importance of descriptor-thinning and noise reduction prior to feature selection

(2011) Probir Kumar Ojha et al.   CHEMOMETRICS AND INTELLIGENT LABORATORY SYSTEMS

Interaction with Polyglutamine Aggregates Reveals a Q/N-rich Domain in TDP-43

(2010) Rodrigo A. Fuentealba et al.   JOURNAL OF BIOLOGICAL CHEMISTRY

The Chemical Biology of Aptamers

(2009) Günter Mayer   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

An overview of influenza haemagglutinin and neuraminidase

(2009) John Skehel   BIOLOGICALS