QSPR prediction of physico-chemical properties for REACH. (Q46439744)

22 December 2017

title

QSPR prediction of physico-chemical properties for REACH. (English)

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22 December 2017

Quantitative Structure–Property Relationship

main subject

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2

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22 December 2017

author name string

J C Dearden

series ordinal

1

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22 December 2017

G Fayet

series ordinal

3

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22 December 2017

publication date

25 March 2013

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22 December 2017

SAR and QSAR in Environmental Research

published in

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22 December 2017

volume

24

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22 December 2017

issue

4

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22 December 2017

page(s)

279-318

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22 December 2017

How not to develop a quantitative structure-activity or structure-property relationship (QSAR/QSPR).

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QSPR correlation of melting point for drug compounds based on different sources of molecular descriptors.

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Correlation of Boiling Points with Molecular Structure. 1. A Training Set of 298 Diverse Organics and a Test Set of 9 Simple Inorganics

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21 January 2018

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21 January 2018

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21 January 2018

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Quantitative structure-property relationships for predicting Henry's law constant from molecular structure

21 January 2018

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21 January 2018

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21 January 2018

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21 January 2018

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21 January 2018

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Development, Validation and Inspection of the Applicability Domain of QSPR Models for Physicochemical Properties of Polybrominated Diphenyl Ethers

21 January 2018

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First Principles Calculations of Aqueous pKaValues for Organic and Inorganic Acids Using COSMO−RS Reveal an Inconsistency in the Slope of the pKaScale

21 January 2018

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10.1080/1062936X.2013.773372

21 January 2018

Identifiers

DOI

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22 December 2017

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22 December 2017