articleTop 1% cited

Molecular recognition of receptor sites using a genetic algorithm with a description of desolvation

Journal of Molecular Biology · 1995 · Vol. 245(1) · pp. 43–53

Gareth Jones(University of Sheffield)Peter Willett(University of Sheffield)Robert C. Glen✉(Wellcome Trust)

Computational Drug Discovery Methods Receptor Mechanisms and Signaling Monoclonal and Polyclonal Antibodies ResearchSteric effectsFlexibility (engineering)MacromoleculeDocking (animal)Computer scienceLigand (biochemistry)Drug designAlgorithmRational designChemistry

MeSH terms

ArabinoseComputer SimulationGalactoseModels, GeneticOxidoreductasesProtein ConformationReceptors, DrugDrug DesignMacromolecular Substances

Citations

1,535

FWCI

31.69

field-weighted impact

References

Percentile

100%

vs. same field & year

Citations per year

Cited by

Binding Affinity via Docking: Fact and Fiction

Molecules · 2018 · 686 citations

Organic & Biomolecular Chemistry · 2004 · 615 citations

Protein–ligand docking: Current status and future challenges

Proteins Structure Function and Bioinformatics · 2006 · 991 citations

Development and validation of a genetic algorithm for flexible docking 1 1Edited by F. E. Cohen

Journal of Molecular Biology · 1997 · 6,621 citations

Bridging Molecular Docking to Molecular Dynamics in Exploring Ligand-Protein Recognition Process: An Overview

Frontiers in Pharmacology · 2018 · 634 citations

Beware of docking!

Trends in Pharmacological Sciences · 2014 · 576 citations

Improved protein–ligand docking using GOLD

Proteins Structure Function and Bioinformatics · 2003 · 3,013 citations

Identification of chemically diverse Chk1 inhibitors by receptor-based virtual screening

Bioorganic & Medicinal Chemistry · 2006 · 362 citations

References

<i>Molecular Theory of Gases and Liquids</i>

Physics Today · 1955 · 11,428 citations

The protein data bank: A computer-based archival file for macromolecular structures

Journal of Molecular Biology · 1977 · 8,620 citations

Automated docking of substrates to proteins by simulated annealing

Proteins Structure Function and Bioinformatics · 1990 · 1,271 citations

A geometric approach to macromolecule-ligand interactions

Journal of Molecular Biology · 1982 · 2,247 citations

Validation of the general purpose tripos 5.2 force field

Journal of Computational Chemistry · 1989 · 2,805 citations

Multivariate Analysis of Ecological Communities.

Journal of Applied Ecology · 1987 · 630 citations

Genetic algorithms in search, optimization, and machine learning

Choice Reviews Online · 1989 · 49,283 citations

Citation Network

How this paper connects to the literature. Drag to explore, click any node to open that paper.