M Sivashanmugam, S KN, UV - Journal of Biomolecular Structure …, 2019 - Taylor & Francis
… naturalinhibitor targeting ODC-mediated disease conditions. … Based on the existing knowledge of known inhibitors for a … naturally occurring chemical compounds Universal Natural …
… These molecules that are evaluated in the present study come from natural plant-type products that have been tested as protease inhibitors against viruses such as HIV, influenza, viral …
… In this study, a virtual structure-based screening was carried … of the natural product berberine, a natural alkaloid based on … site of the OGA inhibitor, constituting promising ligands in the …
… screenednatural products from three different natural product databases against the SBP of InhA for inhibitorscreening … A structure-based virtualscreening approach was implemented …
X Wang, Z Yang, F Su, J Li, EO Boadi, Y Chang… - Molecules, 2020 - mdpi.com
… a method to screen thrombin inhibitors (such as natural flavonoid-type inhibitors) as well as investigate their structure activity relationships. Virtualscreening using molecular docking …
D Yu, J Du, P He, N Wang, L Li, Y Liu, C Yang… - International Journal of …, 2024 - Elsevier
… screeningnaturally occurring XO inhibitors. Therefore, to identify novel druggable XO inhibitors for the treatment of HUA and gout from natural … XO inhibitors through a virtualscreening …
Z Li, B Yang, Y Ding, J Meng, J Hu, X Zhou, L Liu… - International Journal of …, 2023 - Elsevier
… a high-efficiency virtualscreening character, which facilitates … docking analysis, and conduct virtualscreening with reported or … reflect the screening performance in virtualscreening, nor …
WX Wang, YR Zhang, SY Luo, YS Zhang… - Natural Product …, 2022 - Taylor & Francis
Chlorogenic acid (CGA) is a potential inhibitor of Coronavirus Disease 2019 (COVID-19). ACE2 and its co-expressed proteins are SARS-CoV-2 receptors, which have been linked to …
… Therefore, we used this compound as a control to find out more effective inhibitors for COVID-19 during our high throughput virtualscreening experiment of natural compounds. …