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Pharmacophore interactions analysis and prediction of inhibitory activity of 1,7‑diazacarbazoles as checkpoint kinase 1 inhibitors: application of molecular docking, 3D‑QSAR and RBF neural network

Jan 19, 2026 12:10:40 PM

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Molecular docking and QSAR analysis of naphthyridone derivatives as ATAD2 bromodomain inhibitors: application of CoMFA, LS-SVM, and RBF neural network

Jan 19, 2026 12:10:40 PM

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Design new P-glycoprotein modulators based on molecular docking and CoMFA study of a, b-unsaturated carbonyl-based compounds and oxime analogs as anticancer agents

Jan 19, 2026 12:10:40 PM

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Molecular docking and CoMFA studies of thiazoloquin(az)olin(on)es as CD38 inhibitors: determination of inhibitory mechanism, pharmacophore interactions, and design of new inhibitors

Jan 19, 2026 12:10:40 PM

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