(Q45741353)

English

Theoretical study of intramolecular interaction energies during dynamics simulations of oligopeptides by the fragment molecular orbital-Hamiltonian algorithm method

scientific article published in March 2005

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scholarly article

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Europe PubMed Central

PubMed publication ID

15 December 2017

Theoretical study of intramolecular interaction energies during dynamics simulations of oligopeptides by the fragment molecular orbital-Hamiltonian algorithm method (English)

1 reference

Europe PubMed Central

PubMed publication ID

15 December 2017

author name string

Takayoshi Ishimoto

1

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Europe PubMed Central

PubMed publication ID

15 December 2017

Hiroaki Tokiwa

2

1 reference

Europe PubMed Central

PubMed publication ID

15 December 2017

Hiroyuki Teramae

3

1 reference

Europe PubMed Central

PubMed publication ID

15 December 2017

Umpei Nagashima

4

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Europe PubMed Central

PubMed publication ID

15 December 2017

language of work or name

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publication date

1 March 2005

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Europe PubMed Central

PubMed publication ID

15 December 2017

Journal of Chemical Physics

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Europe PubMed Central

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15 December 2017

122

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Europe PubMed Central

PubMed publication ID

15 December 2017

9

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Europe PubMed Central

PubMed publication ID

15 December 2017

094905

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Europe PubMed Central

PubMed publication ID

15 December 2017

Thermal motions and function of bacteriorhodopsin in purple membranes: effects of temperature and hydration studied by neutron scattering

1 reference

https://api.crossref.org/works/10.1063%2F1.1857481

21 January 2018

New Advance in Computational Chemistry: Full Quantum Mechanical ab Initio Computation of Streptavidin-Biotin Interaction Energy

1 reference

https://api.crossref.org/works/10.1063%2F1.1857481

21 January 2018

Fully quantum mechanical energy optimization for protein-ligand structure

1 reference

https://api.crossref.org/works/10.1063%2F1.1857481

21 January 2018

The importance of three-body terms in the fragment molecular orbital method

1 reference

https://api.crossref.org/works/10.1063%2F1.1857481

21 January 2018

Self‐Consistent Molecular‐Orbital Methods. I. Use of Gaussian Expansions of Slater‐Type Atomic Orbitals

1 reference

https://api.crossref.org/works/10.1063%2F1.1857481

21 January 2018

Identifiers

10.1063/1.1857481

1 reference

Europe PubMed Central

PubMed publication ID

15 December 2017

PubMed publication ID

1 reference

Europe PubMed Central

PubMed publication ID

15 December 2017

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