Works matching AU Chavan, Swapnil
Results: 6
Binding site characterization of G protein-coupled receptor by alanine-scanning mutagenesis using molecular dynamics and binding free energy approach: application to C-C chemokine receptor-2 (CCR2).
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- Molecular Diversity, 2012, v. 16, n. 2, p. 401, doi. 10.1007/s11030-012-9368-z
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- Article
Molecular dynamics directed CoMFA studies on carbocyclic neuraminidase inhibitors.
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- Molecular Diversity, 2011, v. 15, n. 4, p. 979, doi. 10.1007/s11030-011-9332-3
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- Article
A k-nearest neighbor classification of hERG K channel blockers.
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- Journal of Computer-Aided Molecular Design, 2016, v. 30, n. 3, p. 229, doi. 10.1007/s10822-016-9898-z
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- Article
Acute Toxicity-Supported Chronic Toxicity Prediction: A k-Nearest Neighbor Coupled Read-Across Strategy.
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- International Journal of Molecular Sciences, 2015, v. 16, n. 5, p. 11659, doi. 10.3390/ijms160511659
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- Article
Towards Global QSAR Model Building for Acute Toxicity: Munro Database Case Study.
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- 2014
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- Case Study
In Silico Prediction of Eye Irritation Using Hansen Solubility Parameters and Predicted pKa Values.
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- Alternatives to Laboratory Animals, 2023, v. 51, n. 3, p. 204, doi. 10.1177/02611929231175676
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- Article