(Q41695013)

7 October 2017

title

k-Nearest neighbors optimization-based outlier removal (English)

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nearest neighbour algorithm

7 October 2017

main subject

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Abraham Yosipof

1

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7 October 2017

Hanoch Senderowitz

series ordinal

2

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7 October 2017

publication date

15 December 2014

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Journal of Computational Chemistry

7 October 2017

published in

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7 October 2017

volume

36

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7 October 2017

issue

8

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7 October 2017

page(s)

493-506

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QSAR modeling: where have you been? Where are you going to?

7 October 2017

cites work

1 reference

Outliers in SAR and QSAR: is unusual binding mode a possible source of outliers?

21 January 2018

1 reference

The importance of outlier detection and training set selection for reliable environmental QSAR predictions.

21 January 2018

1 reference

Trust, but verify: on the importance of chemical structure curation in cheminformatics and QSAR modeling research

21 January 2018

1 reference

Quantitative structure-activity relationship modeling of rat acute toxicity by oral exposure

21 January 2018

1 reference

New support vector algorithms

21 January 2018

1 reference

Data set modelability by QSAR

21 January 2018

1 reference

QSAR modeling of the blood-brain barrier permeability for diverse organic compounds

21 January 2018

1 reference

Correlation and prediction of a large blood-brain distribution data set--an LFER study

21 January 2018

1 reference

Correlation of blood-brain penetration using structural descriptors.

21 January 2018

1 reference

Optimization of molecular representativeness

21 January 2018

1 reference

Introducing conformal prediction in predictive modeling. A transparent and flexible alternative to applicability domain determination.

21 January 2018

1 reference

Spline-fitting with a genetic algorithm: a method for developing classification structure-activity relationships

21 January 2018

1 reference

Unsupervised forward selection: a method for eliminating redundant variables.

21 January 2018

1 reference

A comparative study on feature selection methods for drug discovery.

21 January 2018

1 reference

A review of feature selection techniques in bioinformatics

21 January 2018

1 reference

Novel variable selection quantitative structure--property relationship approach based on the k-nearest-neighbor principle

21 January 2018

1 reference

Identifying Important Risk Factors for Survival in Kidney Graft Failure Patients Using Random Survival Forests

21 January 2018

1 reference

Random forest: a classification and regression tool for compound classification and QSAR modeling

21 January 2018

1 reference

The Importance of Being Earnest: Validation is the Absolute Essential for Successful Application and Interpretation of QSPR Models

21 January 2018

1 reference

QSAR models using a large diverse set of estrogens

21 January 2018

1 reference

ROBPCA: A New Approach to Robust Principal Component Analysis

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1002/JCC.23803

1 reference

7 October 2017

DBLP publication ID

journals/jcc/YosipofS15

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DBLP Dataset 2021-01-02

28 January 2021

1 reference