A supervised fitting approach to force field parametrization with application to the SIBFA polarizable force field. (Q53517192)

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21 March 2020

title

A supervised fitting approach to force field parametrization with application to the SIBFA polarizable force field (English)

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21 March 2020

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3

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21 March 2020

4

Markus Meuwly

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21 March 2020

author name string

Mike Devereux

series ordinal

1

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21 March 2020

Nohad Gresh

series ordinal

2

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publication date

1 August 2014

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Journal of Computational Chemistry

21 March 2020

published in

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volume

35

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21 March 2020

issue

21

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page(s)

1577-1591

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Towards a force field based on density fitting

21 March 2020

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Anisotropic, Polarizable Molecular Mechanics Studies of Inter- and Intramolecular Interactions and Ligand-Macromolecule Complexes. A Bottom-Up Strategy

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Inclusion of the ligand field contribution in a polarizable molecular mechanics: SIBFA-LF.

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21 January 2018

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21 January 2018

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21 January 2018

Identifiers

DOI

10.1002/JCC.23661

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:24965869%20AND%20SRC:MED&resulttype=core&format=json

journals/jcc/DevereuxGPM14

21 March 2020

DBLP publication ID

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DBLP Dataset 2021-01-02

28 January 2021

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