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An overview on applications of SwissADME web tool in the design and development of anticancer, antitubercular and antimicrobial agents: A medicinal chemist's perspective论文
Journal of Molecular Structure2022引用: 275
Benzimidazole and its derivatives as cancer therapeutics: The potential role from traditional to precision medicine论文
Acta Pharmaceutica Sinica B2022引用: 221
Molecular dynamics simulation approach for discovering potential inhibitors against SARS-CoV-2: A structural review论文
Journal of Molecular Liquids2022引用: 250
Molecular Docking: Principles, Advances, and Its Applications in DrugDiscovery论文
Letters in Drug Design & Discovery2022引用: 225
Structure based pharmacophore modeling, virtual screening, molecular docking and ADMET approaches for identification of natural anti-cancer agents targeting XIAP protein论文
Scientific Reports2021引用: 292
Inhibition mechanism of SARS-CoV-2 main protease by ebselen and its derivatives论文
Nature Communications2021引用: 246
X-ray screening identifies active site and allosteric inhibitors of SARS-CoV-2 main protease论文
Science2021引用: 364
Quercetin derivatives: Drug design, development, and biological activities, a review论文
European Journal of Medicinal Chemistry2021引用: 253
Structural Basis of Potential Inhibitors Targeting SARS-CoV-2 Main Protease论文
Frontiers in Chemistry2021引用: 311
Therapeutic target database update 2022: facilitating drug discovery with enriched comparative data of targeted agents论文
Nucleic Acids Research2021引用: 703
Investigation of Some Antiviral N-Heterocycles as COVID 19 Drug: Molecular Docking and DFT Calculations论文
International Journal of Molecular Sciences2020引用: 286
Drug repurposing for coronavirus (COVID-19): <i>in silico</i> screening of known drugs against coronavirus 3CL hydrolase and protease enzymes论文
Journal of Biomolecular Structure and Dynamics2020引用: 371
<p>Potential Impact of the Multi-Target Drug Approach in the Treatment of Some Complex Diseases</p>论文
Drug Design Development and Therapy2020引用: 281
Merging Ligand-Based and Structure-Based Methods in Drug Discovery: An Overview of Combined Virtual Screening Approaches论文
Molecules2020引用: 236
A molecular modeling approach to identify effective antiviral phytochemicals against the main protease of SARS-CoV-2论文
Journal of Biomolecular Structure and Dynamics2020引用: 347
Identification of 14 Known Drugs as Inhibitors of the Main Protease of SARS-CoV-2论文
ACS Medicinal Chemistry Letters2020引用: 220
Putative Inhibitors of SARS-CoV-2 Main Protease from A Library of Marine Natural Products: A Virtual Screening and Molecular Modeling Study论文
Marine Drugs2020引用: 323
Multicomponent reactions (MCR) in medicinal chemistry: a patent review (2010-2020)论文
Expert Opinion on Therapeutic Patents2020引用: 230
Molecular docking, validation, dynamics simulations, and pharmacokinetic prediction of natural compounds against the SARS-CoV-2 main-protease论文
Journal of Biomolecular Structure and Dynamics2020引用: 347
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