X-Pol Potential: An Electronic Structure-Based Force Field for Molecular Dynamics Simulation of a Solvated Protein in Water (Q33863202)

29 July 2017

title

X-Pol Potential: An Electronic Structure-Based Force Field for Molecular Dynamics Simulation of a Solvated Protein in Water (English)

1 reference

29 July 2017

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Donald G Truhlar

3

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Modesto Orozco

series ordinal

2

object named as

Modesto Orozco

1 reference

29 July 2017

Wangshen Xie

1

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29 July 2017

Jiali Gao

series ordinal

4

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29 July 2017

publication date

1 February 2009

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Journal of Chemical Theory and Computation

29 July 2017

published in

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29 July 2017

volume

5

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29 July 2017

issue

3

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29 July 2017

page(s)

459-467

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All-atom empirical potential for molecular modeling and dynamics studies of proteins

29 July 2017

cites work

1 reference

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5 July 2018

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Development of a polarizable intermolecular potential function (PIPF) for liquid amides and alkanes.

5 July 2018

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5 July 2018

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5 July 2018

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5 July 2018

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5 July 2018

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5 July 2018

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5 July 2018

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5 July 2018

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5 July 2018

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5 July 2018

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5 July 2018

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5 July 2018

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29 October 2018

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29 October 2018

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29 October 2018

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29 October 2018

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29 October 2018

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29 October 2018

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29 October 2018

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10 December 2018

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12 December 2020

Polarizable Empirical Force Field for Alkanes Based on the Classical Drude Oscillator Model

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12 December 2020

Class IV charge models: A new semiempirical approach in quantum chemistry

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12 December 2020

Special Issue on Polarization

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12 December 2020

Derivation of Distributed Models of Atomic Polarizability for Molecular Simulations

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12 December 2020

A Polarizable Force Field and Continuum Solvation Methodology for Modeling of Protein-Ligand Interactions

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12 December 2020

Identifiers

DOI

10.1021/CT800239Q

1 reference

29 July 2017

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29 July 2017

1 reference