… as a potential natural inhibitor to target CDK4 in retinoblastoma using virtual screening studies.
… was utilized for virtual screening against the library of natural compounds in Indian Plant …

… of non-peptide natural compound inhibitors for C5aR by homology modeling and virtual
screening. Our study revealed a novel natural compound inhibitor Acteoside with better docking …

… virtual screening was performed to fetch potent inhibitors for … virtual screening to identify
hCA IX based anticancer agents. … hCA IX selective inhibitors based on natural products using …

… Natural products appear in nature to interact with a given receptor (… molecules from natural
sources through combined virtual strategies for the control of tuberculosis through inhibition of …

… linked inhibitor of apoptosis protein (XIAP) is a member of inhibitor … discovered till now as
XIAP inhibitors exhibiting side effects, which … So, the study has design to identifying new natural …

… In the current study, we used an in silico approach to screen natural compounds to find potent
inhibitors of the host enzyme transmembrane protease serine 2 (TMPRSS2). This enzyme …

… 5-LO inhibitors in a natural product collection and natural-product-derived compound libraries.
The selection of screening candidates was guided by ligand-based virtual screening due …

… kinase inhibition of two molecules from a small library of natural compounds and validated
it through biological tests. A good correlation between the Inverse Virtual Screening results …

… We initially used virtual screening to test our in-house library of natural compounds and
synthetic analogs (isolated or prepared by our research group) on the SARS-CoV-2 M pro target. …

Objective of the present investigation comprised of the application of in silico methods to
discover novel natural product (NP) based potential inhibitors for carbohydrate mediated …