(Q52265017)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263849%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

title

A comparison of heuristic search algorithms for molecular docking (English)

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263849%20AND%20SRC:MED&resulttype=core&format=json

informed search algorithm

5 November 2019

main subject

1 reference

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263849%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

author name string

D E Clark

series ordinal

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263849%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

C W Murray

series ordinal

3

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263849%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

publication date

1 May 1997

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263849%20AND%20SRC:MED&resulttype=core&format=json

Journal of Computer - Aided Molecular Design

5 November 2019

published in

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263849%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

volume

11

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263849%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

issue

3

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263849%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

page(s)

209-228

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263849%20AND%20SRC:MED&resulttype=core&format=json

https://scigraph.springernature.com/pub.10.1023/a:1007934310264

5 November 2019

exact match

0 references

cites work

Flexible ligand docking using a genetic algorithm.

1 reference

12 December 2020

Hydration in drug design. 2. Influence of local site surface shape on water binding

1 reference

12 December 2020

Ligand-protein docking and rational drug design.

1 reference

12 December 2020

Hammerhead: fast, fully automated docking of flexible ligands to protein binding sites.

1 reference

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

1 reference

12 December 2020

Local elevation: a method for improving the searching properties of molecular dynamics simulation.

1 reference

12 December 2020

Distributed automated docking of flexible ligands to proteins: Parallel applications of AutoDock 2.4

1 reference

12 December 2020

Ligand docking to proteins with discrete side-chain flexibility.

1 reference

12 December 2020

A comparison of methods for self-adaptation in evolutionary algorithms.

1 reference

12 December 2020

Automated docking of flexible ligands: applications of AutoDock

1 reference

12 December 2020

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1 reference

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A geometric approach to macromolecule-ligand interactions

1 reference

12 December 2020

Refined 2.3 A X-ray crystal structure of bovine thrombin complexes formed with the benzamidine and arginine-based thrombin inhibitors NAPAP, 4-TAPAP and MQPA. A starting point for improving antithrombotics

1 reference

12 December 2020

Computational methods for biomolecular docking.

1 reference

12 December 2020

Placement of medium-sized molecular fragments into active sites of proteins.

1 reference

12 December 2020

Hydration in drug design. 3. Conserved water molecules at the ligand-binding sites of homologous proteins.

1 reference

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Taboo search: an approach to the multiple minima problem.

1 reference

12 December 2020

Influenza B virus neuraminidase can synthesize its own inhibitor

1 reference

12 December 2020

Exploring the energy landscapes of molecular recognition by a genetic algorithm: analysis of the requirements for robust docking of HIV-1 protease and FKBP-12 complexes

1 reference

12 December 2020

Docking small-molecule ligands into active sites

1 reference

12 December 2020

Rational design of potent, bioavailable, nonpeptide cyclic ureas as HIV protease inhibitors

1 reference

12 December 2020

The Protein Data Bank: a computer-based archival file for macromolecular structures

1 reference

12 December 2020

FLOG: a system to select 'quasi-flexible' ligands complementary to a receptor of known three-dimensional structure

1 reference

12 December 2020

Optimization by Simulated Annealing

1 reference

12 December 2020

Molecular recognition of the inhibitor AG-1343 by HIV-1 protease: conformationally flexible docking by evolutionary programming

1 reference

12 December 2020

Automated docking of substrates to proteins by simulated annealing

1 reference

12 December 2020

A fast flexible docking method using an incremental construction algorithm.

1 reference

12 December 2020

Hydration in drug design. 1. Multiple hydrogen-bonding features of water molecules in mediating protein-ligand interactions

1 reference

12 December 2020

Orientational sampling and rigid-body minimization in molecular docking revisited: on-the-fly optimization and degeneracy removal

1 reference

12 December 2020

Molecular docking towards drug discovery

1 reference

12 December 2020

Crystal structures of Escherichia coli and Lactobacillus casei dihydrofolate reductase refined at 1.7 A resolution. I. General features and binding of methotrexate

1 reference

12 December 2020

Identifiers

DOI

10.1023/A:1007934310264

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263849%20AND%20SRC:MED&resulttype=core&format=json

journals/jcamd/WestheadCM97

5 November 2019

DBLP publication ID

1 reference

DBLP Dataset 2021-01-02

Dimensions Publication ID

28 January 2021

1030246339

0 references

1 reference