(Q44957130)

English

Solvation model induced structural changes in peptides. A quantum chemical study on Ramachandran surfaces and conformers of alanine diamide using the polarizable continuum model

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scholarly article

1 reference

Europe PubMed Central

PubMed publication ID

7 December 2017

Solvation model induced structural changes in peptides. A quantum chemical study on Ramachandran surfaces and conformers of alanine diamide using the polarizable continuum model (English)

1 reference

Europe PubMed Central

PubMed publication ID

7 December 2017

1 reference

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author name string

Ilona Hudáky

1

1 reference

Europe PubMed Central

PubMed publication ID

7 December 2017

Péter Hudáky

2

1 reference

Europe PubMed Central

PubMed publication ID

7 December 2017

András Perczel

3

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Europe PubMed Central

PubMed publication ID

7 December 2017

publication date

1 September 2004

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Europe PubMed Central

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7 December 2017

Journal of Computational Chemistry

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Europe PubMed Central

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7 December 2017

25

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Europe PubMed Central

PubMed publication ID

7 December 2017

12

1 reference

Europe PubMed Central

PubMed publication ID

7 December 2017

1522-1531

1 reference

Europe PubMed Central

PubMed publication ID

7 December 2017

Ab initio characterization of building units in peptides and proteins.

1 reference

https://api.crossref.org/works/10.1002%2FJCC.20073

21 January 2018

Peptide models. XXXIII. Extrapolation of low-level Hartree-Fock data of peptide conformation to large basis set SCF, MP2, DFT, and CCSD(T) results. The Ramachandran surface of alanine dipeptide computed at various levels of theory

1 reference

https://api.crossref.org/works/10.1002%2FJCC.20073

21 January 2018

Intrinsically Stable Secondary Structure Elements of Proteins: A Comprehensive Study of Folding Units of Proteins by Computation and by Analysis of Data Determined by X‐ray Crystallography

1 reference

https://api.crossref.org/works/10.1002%2FJCC.20073

21 January 2018

Quantum mechanical study of the conformational behavior of proline and 4R-hydroxyproline dipeptide analogues in vacuum and in aqueous solution

1 reference

https://api.crossref.org/works/10.1002%2FJCC.20073

21 January 2018

Understanding the role of stereoelectronic effects in determining collagen stability. 2. A quantum mechanical/molecular mechanical study of (Proline-Proline-Glycine)(n) polypeptides

1 reference

https://api.crossref.org/works/10.1002%2FJCC.20073

21 January 2018

Conformational attractors on the Ramachandran map.

1 reference

https://api.crossref.org/works/10.1002%2FJCC.20073

21 January 2018

What vibrations tell us about proteins.

1 reference

https://api.crossref.org/works/10.1002%2FJCC.20073

21 January 2018

Convergence acceleration of iterative sequences. the case of scf iteration

1 reference

https://api.crossref.org/works/10.1002%2FJCC.20073

21 January 2018

Role of solvent in determining conformational preferences of alanine dipeptide in water.

1 reference

https://api.crossref.org/works/10.1002%2FJCC.20073

21 January 2018

Identifiers

10.1002/JCC.20073

1 reference

Europe PubMed Central

PubMed publication ID

7 December 2017

DBLP publication ID

journals/jcc/HudakyHP04

1 reference

DBLP Dataset 2021-01-02

28 January 2021

PubMed publication ID

1 reference

Europe PubMed Central

PubMed publication ID

7 December 2017

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