(Q50085791)

24 February 2018

title

Hydration properties of magnesium and calcium ions from constrained first principles molecular dynamics (English)

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24 February 2018

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2

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author name string

Takashi Ikeda

series ordinal

1

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Kiyoyuki Terakura

series ordinal

3

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24 February 2018

language of work or name

English

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publication date

1 August 2007

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24 February 2018

Journal of Chemical Physics

published in

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24 February 2018

volume

127

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issue

7

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24 February 2018

page(s)

074503

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24 February 2018

Metal ions in the structure and function of RNA.

cites work

1 reference

The catalytic diversity of RNAs

21 January 2018

1 reference

Quantum chemical studies of intermediates and reaction pathways in selected enzymes and catalytic synthetic systems

21 January 2018

1 reference

Coordination environment of a site-bound metal ion in the hammerhead ribozyme determined by 15N and 2H ESEEM spectroscopy.

21 January 2018

1 reference

Double-Metal-Ion/Single-Metal-Ion Mechanisms of the Cleavage Reaction of Ribozymes: First-Principles Molecular Dynamics Simulations of a Fully Hydrated Model System

21 January 2018

1 reference

Transient kinetics of the reaction catalysed by magnesium protoporphyrin IX methyltransferase

21 January 2018

1 reference

ATP-induced protein-Hsp70 complex dissociation requires K+ but not ATP hydrolysis.

21 January 2018

1 reference

21 January 2018

1 reference

The hydroxyl of threonine 13 of the bovine 70-kDa heat shock cognate protein is essential for transducing the ATP-induced conformational change

21 January 2018

1 reference

Density functional calculations of ATP systems. 2. ATP hydrolysis at the active site of actin.

21 January 2018

1 reference

Two-metal-ion mechanism for hammerhead-ribozyme catalysis

21 January 2018

1 reference

Three-dimensional structure of a hammerhead ribozyme

21 January 2018

1 reference

A general two-metal-ion mechanism for catalytic RNA

21 January 2018

1 reference

Structure of a C-type mannose-binding protein complexed with an oligosaccharide

21 January 2018

1 reference

Calcium paradox disease: calcium deficiency prompting secondary hyperparathyroidism and cellular calcium overload

21 January 2018

1 reference

Magnesium and the parathyroid

21 January 2018

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Hypomagnesemia with secondary hypocalcemia is caused by mutations in TRPM6, a new member of the TRPM gene family

21 January 2018

1 reference

Hydration of the calcium ion. An EXAFS, large-angle x-ray scattering, and molecular dynamics simulation study

21 January 2018

1 reference

Unified Approach for Molecular Dynamics and Density-Functional Theory

21 January 2018

1 reference

Efficient exploration of reactive potential energy surfaces using Car-Parrinello molecular dynamics

21 January 2018

1 reference

Structure and dynamics of hydrated ions

21 January 2018

1 reference

Environment of Ca2+ ions in aqueous solvent

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1063/1.2768063

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24 February 2018

release_tnu7nuofgvftpphd7eqs3qxp6a

Fatcat ID

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Fatcat

https://api.fatcat.wiki/v0/release/tnu7nuofgvftpphd7eqs3qxp6a

mapped directly with Wikidata item

24 November 2022

based on heuristic

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24 February 2018