(Q42080735)

16 October 2017

1 reference

title

Multilevel Parallelization of AutoDock 4.2. (English)

1 reference

16 October 2017

0 references

0 references

0 references

1 reference

Andrew P Norgan

1

1 reference

16 October 2017

Paul K Coffman

2

1 reference

16 October 2017

Jean-Pierre A Kocher

3

1 reference

16 October 2017

David J Katzmann

4

1 reference

16 October 2017

Carlos P Sosa

5

1 reference

16 October 2017

28 April 2011

1 reference

Journal of Cheminformatics

16 October 2017

1 reference

16 October 2017

3

1 reference

16 October 2017

1

1 reference

16 October 2017

12

1 reference

Creative Commons Attribution 2.0 Generic

16 October 2017

start time

28 April 2011

1 reference

April 2022 Public Data File from Crossref

copyright status

copyrighted

1 reference

April 2022 Public Data File from Crossref

exact match

https://scigraph.springernature.com/pub.10.1186/1758-2946-3-12

0 references

cites work

Virtual Screening with AutoDock: Theory and Practice

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Virtual screening for HIV protease inhibitors: a comparison of AutoDock 4 and Vina

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Dockres: a computer program that analyzes the output of virtual screening of small molecules

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Docking and chemoinformatic screens for new ligands and targets

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Virtual screening - what does it give us?

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

DOVIS 2.0: an efficient and easy to use parallel virtual screening tool based on AutoDock 4.0.

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

DOVIS: an implementation for high-throughput virtual screening using AutoDock

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Virtual screening strategies in drug discovery

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Development and validation of a modular, extensible docking program: DOCK 5.

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Protein-ligand docking: current status and future challenges

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

ZINC--a free database of commercially available compounds for virtual screening

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Virtual screening of chemical libraries

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Discovery of a novel binding trench in HIV integrase.

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Python: a programming language for software integration and development

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Automated docking of flexible ligands: applications of AutoDock

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Task-parallel message passing interface implementation of Autodock4 for docking of very large databases of compounds using high-performance super-computers.

30 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

VSDocker: a tool for parallel high-throughput virtual screening using AutoDock on Windows-based computer clusters.

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Critical assessment of the automated AutoDock as a new docking tool for virtual screening.

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3098179

Parallel implementation ofAutoDock

17 August 2018

1 reference

COCI

https://opencitations.net/index/coci/api/v1/references/10.1186/1758-2946-3-12

Massive docking of flexible ligands using environmental niches in parallelized genetic algorithms

2 January 2022

1 reference

COCI

https://opencitations.net/index/coci/api/v1/references/10.1186/1758-2946-3-12

Automated docking using a Lamarckian genetic algorithm and an empirical binding free energy function

2 January 2022

1 reference

COCI

https://opencitations.net/index/coci/api/v1/references/10.1186/1758-2946-3-12

2 January 2022

Identifiers

DOI

10.1186/1758-2946-3-12

1 reference

journals/jcheminf/NorganCKKS11

16 October 2017

1 reference

DBLP Dataset 2021-01-02

Dimensions Publication ID

28 January 2021

0 references

1 reference

16 October 2017

1 reference