Virtual screening in drug design and development

SF Sousa, N MFSA Cerqueira… - … screening, 2010 - ingentaconnect.com
… of the virtual screening process and of its importance in the present drug discovery and …
to the general types of virtual screening methodologies is presented. The main stages of a …

Virtual screening and its integration with modern drug design technologies

AD Andricopulo, RVC Guido… - Current medicinal …, 2008 - ingentaconnect.com
… number of promising candidates for drug design. This review provides a perspective of
the utility of virtual screening in drug design and its integration with other important drug dis- …

Virtual screening in drug design

M Lill - In Silico Models for Drug Discovery, 2013 - Springer
Virtual screening has become a standard tool in drug discovery to identify novel lead … I
present several concepts in ligand-based and structure-based virtual screening and discuss some …

Virtual screening of drugs: score functions, docking, and drug design

A Breda, LA Basso, DS Santos… - … -Aided Drug Design, 2008 - ingentaconnect.com
… addressed for usefulness of virtual screening results. The present review is focused on these
… and their implication for virtual screening. Keywords: Virtual screening, drug design, protein …

Virtual screening: a fast tool for drug design

V Vyas, A Jain, A Jain, A Gupta - Scientia Pharmaceutica, 2008 - mdpi.com
Virtual screening, sometime also called in-silico screening, is … screening database in search
for the novel drug leads. The … virtual screening go back to the structure-based drug design

[PDF][PDF] Virtual screening strategies in drug design–methods and applications

E Bielska, X Lucas, A Czerwoniec, JM Kasprzak… - …, 2011 - journals.pan.pl
Virtual screening (VS) overcomes the limitations of traditional high-throughput screening (HTS)
by applying computer-based methods in drug discovery. VS takes advantage of fast …

[HTML][HTML] Drug design by pharmacophore and virtual screening approach

D Giordano, C Biancaniello, MA Argenio, A Facchiano - Pharmaceuticals, 2022 - mdpi.com
… the virtual screening of … virtual screening are available and generated successful studies.
This article describes the procedure of pharmacophore modelling followed by virtual screening, …

Applications of quantitative structure-activity relationships (QSAR) based virtual screening in drug design: A review

PGR Achary - Mini Reviews in Medicinal Chemistry, 2020 - ingentaconnect.com
… of QSAR based VS in the drug discovery, the … drug design, to explore the capability of
QSAR based VS, will motivate to use the databases and Other Computer Aided Drug Design

Virtual screening and drug design for PDE-5 receptor from traditional Chinese medicine database

CYC Chen - Journal of Biomolecular Structure and Dynamics, 2010 - Taylor & Francis
… To developed new PDE-5 inhibitors, we performed a virtual screening of traditional Chinese
medicine (TCM) database and docking analyses to identify candidates. Known PDE-5 …

Structure-based virtual screening for drug discovery: principles, applications and recent advances

E Lionta, G Spyrou, DK Vassilatis… - Current topics in …, 2014 - ingentaconnect.com
… -based drug design methods include virtual screening (VS) and de novo drug design; these
… In virtual screening, large libraries of drug-like compounds that are commercially available …