(Q34552776)

3 August 2017

1 reference

title

Mining collections of compounds with Screening Assistant 2 (English)

1 reference

3 August 2017

Vincent Le Guilloux

1

1 reference

3 August 2017

Alban Arrault

2

1 reference

3 August 2017

Lionel Colliandre

3

1 reference

3 August 2017

Stéphane Bourg

4

1 reference

3 August 2017

Philippe Vayer

5

1 reference

3 August 2017

Luc Morin-Allory

6

1 reference

3 August 2017

publication date

31 August 2012

1 reference

Journal of Cheminformatics

3 August 2017

published in

1 reference

3 August 2017

volume

4

1 reference

3 August 2017

issue

1

1 reference

3 August 2017

page(s)

20

1 reference

Creative Commons Attribution 2.0 Generic

3 August 2017

copyright license

start time

31 August 2012

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.10.1186/1758-2946-4-20

0 references

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7 July 2018

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7 July 2018

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7 July 2018

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7 July 2018

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7 July 2018

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New substructure filters for removal of pan assay interference compounds (PAINS) from screening libraries and for their exclusion in bioassays

7 July 2018

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7 July 2018

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7 July 2018

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7 July 2018

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Novel trends in high-throughput screening

7 July 2018

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Interactive exploration of chemical space with Scaffold Hunter

7 July 2018

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Plate-based diversity selection based on empirical HTS data to enhance the number of hits and their chemical diversity

7 July 2018

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Chemical substructures that enrich for biological activity

7 July 2018

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New directions in library design and analysis

7 July 2018

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Managing, profiling and analyzing a library of 2.6 million compounds gathered from 32 chemical providers

7 July 2018

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Recent Developments of the Chemistry Development Kit (CDK) - An Open-Source Java Library for Chemo- and Bioinformatics

7 July 2018

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7 July 2018

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Reagent Selector: using Synthon Analysis to visualize reagent properties and assist in combinatorial library design

2022

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REALISIS: a medicinal chemistry-oriented reagent selection, library design, and profiling platform

7 July 2018

1 reference

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Design of a compound screening collection for use in high throughput screening

7 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3547782

A ‘Rule of Three’ for fragment-based lead discovery?

7 July 2018

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Designing screens: how to make your hits a hit.

7 July 2018

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The Chemistry Development Kit (CDK): an open-source Java library for Chemo- and Bioinformatics

7 July 2018

has goal

uses method in cited work

2 references

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3547782

7 July 2018

CiteULike CiTO annotations

Nonleadlikeness and leadlikeness in biochemical screening

2022

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3547782

Is there a difference between leads and drugs? A historical perspective

7 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3547782

Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings

7 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3547782

Implementation of a system for reagent selection and library enumeration, profiling, and design

7 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3547782

The properties of known drugs. 1. Molecular frameworks

7 July 2018

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The Taverna Interaction Service: enabling manual interaction in workflows

7 July 2018

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Impact of high-throughput screening in biomedical research

21 January 2018

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https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3547782

Maximum-score diversity selection for early drug discovery.

27 October 2018

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https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3547782

Designing compound subsets: comparison of random and rational approaches using statistical simulation.

27 October 2018

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https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3547782

Drug discovery: A question of library design

27 October 2018

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From Structure Diagrams to Visual Chemical Patterns

21 January 2018

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High-throughput hit finding and compound-profiling technologies for academic drug discovery

9 December 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/23327565

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Computation and management of chemical properties in CACTVS: An extensible networked approach toward modularity and compatibility

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https://opencitations.net/index/coci/api/v1/references/10.1186/1758-2946-4-20

Chapter 17. Open Source Tools for Read-Across and Category Formation

2 January 2022

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COCI

https://opencitations.net/index/coci/api/v1/references/10.1186/1758-2946-4-20

2 January 2022

Identifiers

DOI

10.1186/1758-2946-4-20

1 reference

journals/jcheminf/GuillouxACBVM12

3 August 2017

DBLP publication ID

1 reference

DBLP Dataset 2021-01-02

Dimensions Publication ID

28 January 2021

0 references

1 reference

3 August 2017

1 reference