The pharmacophore concept and its applications in computer-aided drug design
Pharmacophore-based techniques currently are an integral part of many computer-aided
drug design workflows and have been successfully and extensively applied for tasks such …
drug design workflows and have been successfully and extensively applied for tasks such …
Applications of the pharmacophore concept in natural product inspired drug design
Pharmacophore‐based techniques are nowadays an important part of many computer‐
aided drug design workflows and have been successfully applied for tasks such as virtual …
aided drug design workflows and have been successfully applied for tasks such as virtual …
Pharmacophore modeling and applications in drug discovery: challenges and recent advances
SY Yang - Drug discovery today, 2010 - Elsevier
Pharmacophore approaches have become one of the major tools in drug discovery after the
past century's development. Various ligand-based and structure-based methods have been …
past century's development. Various ligand-based and structure-based methods have been …
Pharmacophore modeling: advances, limitations, and current utility in drug discovery
X Qing, X Yin Lee, J De Raeymaeker… - Journal of Receptor …, 2014 - Taylor & Francis
Pharmacophore modeling is a successful yet very diverse subfield of computer-aided drug
design. The concept of the pharmacophore has been widely applied to the rational design of …
design. The concept of the pharmacophore has been widely applied to the rational design of …
History and evolution of the pharmacophore concept in computer-aided drug design
OF Guner - Current topics in medicinal chemistry, 2002 - ingentaconnect.com
With computer-aided drug design established as an integral part of the lead discovery and
optimization process, pharmacophores have become a focal point for conceptualizing and …
optimization process, pharmacophores have become a focal point for conceptualizing and …
3D Pharmacophore Modeling Techniques in Computer‐Aided Molecular Design Using LigandScout
This chapter reviews theory related to pharmacophore models and guide the user through
six essential workflows using LigandScout: structure‐based pharmacophore modeling …
six essential workflows using LigandScout: structure‐based pharmacophore modeling …
Pharmacophores in drug research
T Langer - Molecular Informatics, 2010 - Wiley Online Library
The pharmacophore concept in modern drug research is highlighted and the most important
use examples and success stories are reviewed. These include papers from method …
use examples and success stories are reviewed. These include papers from method …
[PDF][PDF] The impact of pharmacophore modeling in drug design
OF Guner - IDrugs, 2005 - academia.edu
With the reliable use of computer simulations in scientific research, it is possible to achieve
significant increases in productivity as well as a reduction in research costs compared with …
significant increases in productivity as well as a reduction in research costs compared with …
Pharmacophore modeling in drug discovery: methodology and current status
MT Muhammed, E Akı-yalcın - Journal of the Turkish Chemical …, 2021 - dergipark.org.tr
A pharmacophore describes the framework of molecular features that are vital for the
biological activity of a compound. Pharmacophore models are built by using the structural …
biological activity of a compound. Pharmacophore models are built by using the structural …
Pharmacophore-based virtual screening
D Horvath - Chemoinformatics and computational chemical biology, 2011 - Springer
This chapter is a review of the most recent developments in the field of pharmacophore
modeling, covering both methodology and application. Pharmacophore-based virtual …
modeling, covering both methodology and application. Pharmacophore-based virtual …