(Q34602658)

3 August 2017

title

Modeling aqueous solvation with semi-explicit assembly (English)

1 reference

3 August 2017

3

Ken A Dill

1 reference

3 August 2017

2

Charles W Kehoe

1 reference

3 August 2017

author name string

Christopher J Fennell

series ordinal

1

1 reference

3 August 2017

language of work or name

English

0 references

publication date

7 February 2011

1 reference

Proceedings of the National Academy of Sciences of the United States of America

3 August 2017

published in

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3 August 2017

volume

108

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3 August 2017

issue

8

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3 August 2017

page(s)

3234-3239

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GROMACS 4: Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation

3 August 2017

cites work

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7 July 2018

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7 July 2018

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7 July 2018

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An efficient hybrid explicit/implicit solvent method for biomolecular simulations

7 July 2018

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7 July 2018

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7 July 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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Estimation of Absolute Free Energies of Hydration Using Continuum Methods: Accuracy of Partial Charge Models and Optimization of Nonpolar Contributions

21 January 2018

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Implicit nonpolar solvent models

21 January 2018

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Towards molecular dynamics simulation of large proteins with a hydration shell at constant pressure.

21 January 2018

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Comparison of simple potential functions for simulating liquid water

21 January 2018

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Size dependent ion hydration, its asymmetry, and convergence to macroscopic behavior

21 January 2018

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21 January 2018

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21 January 2018

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Investigation of Salt Bridge Stability in a Generalized Born Solvent Model.

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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An SCF Solvation Model for the Hydrophobic Effect and Absolute Free Energies of Aqueous Solvation

21 January 2018

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Free Energy of Ionic Hydration

26 October 2018

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A Blind Challenge for Computational Solvation Free Energies: Introduction and Overview

21 January 2018

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PubMed

https://pubmed.ncbi.nlm.nih.gov/21300905

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Multiscale Coarse-Graining of Mixed Phospholipid/Cholesterol Bilayers

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/21300905

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Hydration thermodynamic properties of amino acid analogues: a systematic comparison of biomolecular force fields and water models

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/21300905

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.1073/PNAS.1017130108

1 reference

3 August 2017

0 references

1 reference

3 August 2017

1 reference