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Garima, S. Sharma, J. Sindhu & P. Kumar. (2023) QSAR study of tetrahydropteridin derivatives as polo-like kinase 1(PLK1) Inhibitors with molecular docking and dynamics study. SAR and QSAR in Environmental Research 34:2, pages 91-116.
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P. Kumar, R. Singh, A. Kumar, A.P. Toropova, A.A. Toropov, M. Devi, S. Lal, J. Sindhu & D. Singh. (2022) Identifications of good and bad structural fragments of hydrazone/2,5-disubstituted-1,3,4-oxadiazole hybrids with correlation intensity index and consensus modelling using Monte Carlo based QSAR studies, their molecular docking and ADME analysis. SAR and QSAR in Environmental Research 33:9, pages 677-700.
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A.P. Toropova, A.A. Toropov, E.L. Viganò, E. Colombo, A. Roncaglioni & E. Benfenati. (2022) Carcinogenicity prediction using the index of ideality of correlation. SAR and QSAR in Environmental Research 33:6, pages 419-428.
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J. Devillers, V. Sartor, J.P. Doucet, A. Doucet-Panaye & H. Devillers. (2022) In silico prediction of mosquito repellents for clothing application. SAR and QSAR in Environmental Research 33:4, pages 239-257.
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S. Ahmadi, S. Lotfi, S. Afshari, P. Kumar & E. Ghasemi. (2021) CORAL: Monte Carlo based global QSAR modelling of Bruton tyrosine kinase inhibitors using hybrid descriptors. SAR and QSAR in Environmental Research 32:12, pages 1013-1031.
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Articles from other publishers (7)
Hamideh Hamzehali, Shahram Lotfi, Shahin Ahmadi & Parvin Kumar. (2022) Quantitative structure–activity relationship modeling for predication of inhibition potencies of imatinib derivatives using SMILES attributes. Scientific Reports 12:1.
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Rahul Singh, Parvin Kumar, Meena Devi, Sohan Lal, Ashwani Kumar, Jayant Sindhu, Alla P. Toropova, Andrey A. Toropov & Devender Singh. (2022) Monte Carlo based QSGFEAR: prediction of Gibb's free energy of activation at different temperatures using SMILES based descriptors. New Journal of Chemistry 46:39, pages 19062-19072.
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Parvin Kumar, Ashwani Kumar, Sohan Lal, Devender Singh, Shahram Lotfi & Shahin Ahmadi. (2022) CORAL: Quantitative Structure Retention Relationship (QSRR) of flavors and fragrances compounds studied on the stationary phase methyl silicone OV-101 column in gas chromatography using correlation intensity index and consensus modelling. Journal of Molecular Structure 1265, pages 133437.
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Shahram Lotfi, Shahin Ahmadi & Parvin Kumar. (2022)
Ecotoxicological prediction of organic chemicals toward
Pseudokirchneriella subcapitata
by Monte Carlo approach
. RSC Advances 12:38, pages 24988-24997.
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Parvin Kumar, Ashwani Kumar & Devender Singh. (2022) CORAL: Development of a hybrid descriptor based QSTR model to predict the toxicity of dioxins and dioxin-like compounds with correlation intensity index and consensus modelling. Environmental Toxicology and Pharmacology 93, pages 103893.
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Andrey A. Toropov, Alla P. Toropova & Valentin O. Kudyshkin. (2022) The system of self-consistent QSPR-models for refractive index of polymers. Structural Chemistry 33:2, pages 617-624.
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Shahram Lotfi, Shahin Ahmadi & Parvin Kumar. (2021) The Monte Carlo approach to model and predict the melting point of imidazolium ionic liquids using hybrid optimal descriptors. RSC Advances 11:54, pages 33849-33857.
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