Virtual screening strategies in drug discovery

C McInnes - Current opinion in chemical biology, 2007 - Elsevier
… of lead molecules in drug discovery. Refinements and … virtual screening methods, concomitant
developments in cheminformatics including identification, design and manipulation of drug

Virtual screening strategies in drug discovery: a critical review

A Lavecchia, C Di Giovanni - Current medicinal chemistry, 2013 - ingentaconnect.com
… of hits by computational methods such as virtual screening (VS) can represent a crucial step
in early-stage drug discovery. The first time the term “virtual screening” appeared in a peer-…

Docking and scoring in virtual screening for drug discovery: methods and applications

DB Kitchen, H Decornez, JR Furr… - … reviews Drug discovery, 2004 - nature.com
… Computational methodologies have become a crucial component of many drug discovery
structure-based virtual screening 7 techniques are widely used in many discovery efforts. One …

Virtual screening in drug discovery-a computational perspective

AS Reddy, SP Pati, PP Kumar… - Current Protein and …, 2007 - ingentaconnect.com
… Abstract: Virtual screening emerged as an important tool in our quest to access novel drug
… and contrasting methodological protocols available in screening databases for the lead com…

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 is proven to be more efficient than the traditional way of drug discovery
… In this review, we focus on the principles and applications of Virtual Screening (VS) within …

What has virtual screening ever done for drug discovery?

DE Clark - Expert opinion on drug discovery, 2008 - Taylor & Francis
virtual screening is now widely applied as a hit-finding methodology within drug discovery
… Objective: To assess the impact of virtual screening on drug discovery. Method: Such cases …

Virtual screening in drug discovery

AR Patel, HB Patel, SK Mody, RD Singh… - Journal of Veterinary …, 2021 - indianjournals.com
… of natural products with virtual screening will play an important role in drug discovery in the
Virtual screening play an essential role in accelerating the early stage of drug discovery by …

Docking and virtual screening in drug discovery

M Kontoyianni - Proteomics for drug discovery: Methods and protocols, 2017 - Springer
… Stages in a typical drug discovery organization include target selection, hit identification, …
-based virtual screening (VS) has been a staple for more than a decade now in drug discovery

Virtual screening techniques in drug discovery: review and recent applications

SFL da Silva Rocha, CG Olanda… - Current topics in …, 2019 - ingentaconnect.com
… of drug discovery there are two types of screening libraries to … turally diverse screening
compounds so that novel drug hits … the screening of compounds structurally similar to a drug lead …

The holistic integration of virtual screening in drug discovery

Y Tanrikulu, B Krüger, E Proschak - Drug Discovery Today, 2013 - Elsevier
… level of maturation of virtual screening in drug discovery. ► Virtual screening is not applied
… We propose a classification of integration levels of virtual screening in drug discovery. ► …