Full article: Virtual screening, pharmacokinetics, molecular dynamics and binding free
energy analysis for small natural molecules against cyclin-dependent kinase 5 for Alzheimer’s …

Bioprospecting has contributed to the work of pharmaceutical chemists in the development
and commercial disposal of new drugs. Currently, the pharmaceutical industry has …

… In the present study, structure-based virtual screening was performed to identify the potential
lead molecule from zinc natural compound databases. The retrieved hit compounds were …

… for structure-based virtual screening of several chemical … and pharmacokinetic analyses
are additional (virtual) screening … drug likeness and pharmacokinetic properties are based on …

… Our conclusion suggests that the virtual screened compound (PubChem … virtual screened
compounds, with a compound having (PubChem CDI: 10151468) emerging as the best virtual …

… In this paper, the integrated pharmacokinetics (PK) of an Acanthopanax senticosus extract …
multi-component PK in rats, virtual screening, systems pharmacology and molecular docking. …

… carica Linn, have a binding affinity for PPAR-γ, as a result, the current research aims to
virtual screening of active biomolecules from F. carica Linn. against the PPAR-γ through the In-…

… (QPLD), pharmacokinetic studies and biological activity … , inhibitory potential and
pharmacokinetic properties of Traditional … Pharmacokinetic studies revealed that Rutaecarpine …

… Both natural and synthetic anti-viral compounds were selected for virtual screening against
the three structural proteins, ie, envelope (E), membrane (M) and nucleocapsid (N) protein. …

This research aimed to conduct an in silico study of compounds, mainly flavonoids, that are
found in several plants, including the species of the Chamaecrista genus. The ADME …