… in the search for bioactive natural products are in great demand to find the ‘needles in a
haystack’, computational assistance could hardly break into natural product research. …

… of bioactive agents and … virtual screening, which has shown a great promise in drug
discovery, will play an important role in digging out lead (active) compounds from natural products…

… nature. Focusing on 3D pharmacophore modeling techniques, we provide an overview of
virtual screening … as sources for chemical structures of natural products, discuss techniques for …

… In the present study, we have performed structure-based virtual high-throughput screening
of natural compounds from the ZINC database to find potential inhibitors of SGK1. Initially, hits …

… In the present report, the concept of inverse virtual screening has been introduced. The
application of this method may facilitate the prediction of the activity of secondary metabolites …

… steps applied in virtual screening workflows to select bioactive natural products. (B) Ligand-
… exhibit those with potential applications in virtual screening strategies of natural products. …

… other researchers to perform virtual screenings of activity in various … natural products available
for searching bioactive compounds. It also describes the main features of virtual screening …

… that apply different methods of virtual screening to select natural products with potential
anticancer activity. … Identification of bioactive natural products by pharmacophore-based virtual …

… from natural products. This review also gives emphasis on the strategy of virtual screening
based on … of bioactive molecules by various virtual screening methods are given in Table 2. …

… Databases play an important role in various computational techniques, including virtual
screening (… For example, vendor, bioactivity data or target type can be found when searching a …