(Q27902269)

English

Benchmark of four popular virtual screening programs: construction of the active/decoy dataset remains a major determinant of measured performance

scientific article (publication date: 2016)

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scholarly article

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Benchmark of four popular virtual screening programs: construction of the active/decoy dataset remains a major determinant of measured performance (English)

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based on heuristic

inferred from title

virtual screening

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based on heuristic

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author name string

Ludovic Chaput

1

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Juan Martinez-Sanz

2

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Nicolas Saettel

3

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Liliane Mouawad

4

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language of work or name

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publication date

2016

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Journal of Cheminformatics

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8

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1

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56

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copyright license

Creative Commons Attribution 4.0 International

17 October 2016

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April 2022 Public Data File from Crossref

copyright status

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vSDC: a method to improve early recognition in virtual screening when limited experimental resources are available

1 reference

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Fast, scalable generation of high-quality protein multiple sequence alignments using Clustal Omega

1 reference

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Surflex: fully automatic flexible molecular docking using a molecular similarity-based search engine

1 reference

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1 reference

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Community benchmarks for virtual screening

1 reference

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1 reference

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1 reference

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Development and validation of a genetic algorithm for flexible docking

1 reference

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20 March 2017

Benchmarking sets for molecular docking

1 reference

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1 reference

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1 reference

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1 reference

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1 reference

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1 reference

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1 reference

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Pose prediction and virtual screening performance of GOLD scoring functions in a standardized test.

1 reference

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Analysis of multiple compound-protein interactions reveals novel bioactive molecules

1 reference

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1 reference

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Molecular docking screens using comparative models of proteins

1 reference

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1 reference

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1 reference

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1 reference

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1 reference

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1 reference

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1 reference

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1 reference

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21 January 2018

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1 reference

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1 reference

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1 reference

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Evaluating virtual screening methods: good and bad metrics for the "early recognition" problem.

1 reference

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1 reference

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

1 reference

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New method for fast and accurate binding-site identification and analysis

1 reference

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12 December 2020

based on heuristic

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Identifiers

10.1186/S13321-016-0167-X

1 reference

Consolidated OpenCitations Corpus – April 2017

OpenCitations bibliographic resource ID

DBLP publication ID

journals/jcheminf/ChaputMSM16

1 reference

DBLP Dataset 2021-01-02

28 January 2021

Dimensions Publication ID

1 reference

9 September 2019

https://scigraph.springernature.com/pub.10.1186/s13321-016-0167-x

OpenCitations bibliographic resource ID

1 reference

Consolidated OpenCitations Corpus – April 2017

OpenCitations bibliographic resource ID

PMC publication ID

1 reference

Consolidated OpenCitations Corpus – April 2017

OpenCitations bibliographic resource ID

PubMed publication ID

1 reference

Consolidated OpenCitations Corpus – April 2017

OpenCitations bibliographic resource ID

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