(Q31086189)

28 June 2017

title

Neutron diffraction and simulation studies of the exocyclic hydroxymethyl conformation of glucose (English)

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28 June 2017

Gabriel Cuello

5

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ORCID Public Data File 2021

author name string

Philip E Mason

1

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28 June 2017

George W Neilson

2

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28 June 2017

John E Enderby

3

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28 June 2017

Marie-Louise Saboungi

4

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28 June 2017

John W Brady

6

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28 June 2017

language of work or name

English

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publication date

1 December 2006

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Journal of Chemical Physics

28 June 2017

published in

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28 June 2017

volume

125

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28 June 2017

issue

22

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28 June 2017

page(s)

224505

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Crystal structure and hydrogen-bonding system in cellulose Ibeta from synchrotron X-ray and neutron fiber diffraction

28 June 2017

cites work

1 reference

Theoretical study of the relative stability of rotational conformers of alpha and beta-D-glucopyranose in gas phase and aqueous solution

21 January 2018

1 reference

Neutron diffraction and computer simulation studies of D-xylose

21 January 2018

1 reference

Determination of a hydroxyl conformation in aqueous xylose using neutron scattering and molecular dynamics

21 January 2018

1 reference

Structure of aqueous glucose solutions as determined by neutron diffraction with isotopic substitution experiments and molecular dynamics calculations

21 January 2018

1 reference

CHARMM: A program for macromolecular energy, minimization, and dynamics calculations

21 January 2018

1 reference

Carbohydrate solution simulations: producing a force field with experimentally consistent primary alcohol rotational frequencies and populations

21 January 2018

1 reference

21 January 2018

1 reference

Relative stability of alternative chair forms and hydroxymethyl conformations of β-d-glucopyranose

21 January 2018

1 reference

Quantum chemical conformational analysis of glucose in aqueous solution

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1063/1.2393237

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28 June 2017

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