(Q34156744)

31 July 2017

title

Nonlinear dimensionality reduction and mapping of compound libraries for drug discovery (English)

1 reference

nonlinear dimensionality reduction

31 July 2017

main subject

dimensionality reduction

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based on heuristic

inferred from title

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1 reference

2

Gisbert Schneider

1 reference

31 July 2017

Michael Reutlinger

1

1 reference

31 July 2017

publication date

2 January 2012

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Journal of Molecular Graphics & Modelling

31 July 2017

published in

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31 July 2017

volume

34

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31 July 2017

page(s)

108-117

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Interpreting linear support vector machine models with heat map molecule coloring

31 July 2017

cites work

1 reference

https://opencitations.net/index/coci/api/v1/citations/10.1186/1758-2946-3-11

Multiple search methods for similarity-based virtual screening: analysis of search overlap and precision

2 January 2022

1 reference

https://opencitations.net/index/coci/api/v1/citations/10.1186/1758-2946-3-29

Chemical Entities of Biological Interest: an update

2 January 2022

1 reference

4 April 2022

https://opencitations.net/index/coci/api/v1/citations/10.1093/NAR/GKP886

ChemMine tools: an online service for analyzing and clustering small molecules

1 reference

4 April 2022

https://opencitations.net/index/coci/api/v1/citations/10.1093/NAR/GKR320

Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information

1 reference

4 April 2022

https://opencitations.net/index/coci/api/v1/citations/10.1007/S10822-011-9440-2

Structure−Activity Landscape Index: Identifying and Quantifying Activity Cliffs

1 reference

4 April 2022

https://opencitations.net/index/coci/api/v1/citations/10.1021/CI7004093

Self-Organizing Maps for In Silico Screening and Data Visualization

1 reference

https://opencitations.net/index/coci/api/v1/citations/10.1002/MINF.201100082

Stochastic Proximity Embedding: Methods and Applications.

8 April 2023

1 reference

https://opencitations.net/index/coci/api/v1/citations/10.1002/MINF.201000134

Visual Interpretation of Kernel-Based Prediction Models.

8 April 2023

1 reference

https://opencitations.net/index/coci/api/v1/citations/10.1002/MINF.201100059

QSAR applicabilty domain estimation by projection of the training set descriptor space: a review

8 April 2023

1 reference

https://opencitations.net/index/api/v1/citations/10.1177/026119290503300508

10.1016/J.JMGM.2011.12.006

18 January 2024

Identifiers

DOI

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release_mxmoagi67rbd7j7n36qm3rgdty

31 July 2017

Fatcat ID

1 reference

Fatcat

https://api.fatcat.wiki/v0/release/mxmoagi67rbd7j7n36qm3rgdty

mapped directly with Wikidata item

24 November 2022

based on heuristic

1 reference