Ligand-based 3D pharmacophore modeling, virtual screening, and molecular dynamic simulation of potential smoothened inhibitors
A Mohebbi - Journal of Molecular Modeling, 2023 - Springer
Abstract Context The Hedgehog (Hh) signaling pathway is a crucial regulator of various
cellular processes. Dysregulated activation of the Smoothened (SMO) oncoprotein, a key …
cellular processes. Dysregulated activation of the Smoothened (SMO) oncoprotein, a key …
Pharmacophore modeling and QSAR analysis of anti-HBV flavonols
Due to its global burden, Targeting Hepatitis B virus (HBV) infection in humans is crucial.
Herbal medicine has long been significant, with flavonoids demonstrating promising results …
Herbal medicine has long been significant, with flavonoids demonstrating promising results …
Ligand-based pharmacophore modeling, virtual screening, and 2D quantitative structure-activity relationship performance on anti-Hepatitis B virus flavonols
Background: Targeting Hepatitis B virus (HBV) infection in human is crucial due to its
adverse. Herbal medicine has long been significant in this regard, with flavonoids …
adverse. Herbal medicine has long been significant in this regard, with flavonoids …
[PDF][PDF] Computer screening of peptidomimetics and small-molecule ligands of B-cell membrane proteins for therapy of Burkitt lymphoma
I Demianenko, A Bakhmach - Bulletin of Medical and Biological …, 2023 - bmbr.com.ua
The capabilities of molecular modelling and docking allow for the discovery of new potential
drug agents to improve the treatment of diseases, which is a current concern. The objective …
drug agents to improve the treatment of diseases, which is a current concern. The objective …