The interactions of phenylalanines in β-sheet-like structures from molecular orbital calculations using density functional theory (DFT), MP2, and CCSD(T) methods
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Virtual and In Vitro Screens Reveal a Potential Pharmacophore that Avoids the Fibrillization of Aβ1-42Capping parallel β-sheets of acetyl(Ala)6NH2 with an acetyl(Ala)5ProNH2 can arrest the growth of the sheet, suggesting a potential for curtailing amyloid growth. An ONIOM and density functional theory study.Density functional theory study of the interaction of vinyl radical, ethyne, and ethene with benzene, aimed to define an affordable computational level to investigate stability trends in large van der Waals complexes.
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The interactions of phenylalanines in β-sheet-like structures from molecular orbital calculations using density functional theory (DFT), MP2, and CCSD(T) methods
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article científic
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article scientifique
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articolo scientifico
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artigo científico
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bilimsel makale
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scientific article published on June 2013
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vedecký článok
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vetenskaplig artikel
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videnskabelig artikel
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vědecký článek
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The interactions of phenylalan ...... DFT), MP2, and CCSD(T) methods
@en
The interactions of phenylalan ...... FT), MP2, and CCSD(T) methods.
@nl
type
label
The interactions of phenylalan ...... DFT), MP2, and CCSD(T) methods
@en
The interactions of phenylalan ...... FT), MP2, and CCSD(T) methods.
@nl
prefLabel
The interactions of phenylalan ...... DFT), MP2, and CCSD(T) methods
@en
The interactions of phenylalan ...... FT), MP2, and CCSD(T) methods.
@nl
P2093
P2860
P356
P1476
The interactions of phenylalan ...... DFT), MP2, and CCSD(T) methods
@en
P2093
Gabor Pohl
J J Dannenberg
Joshua A Plumley
P2860
P304
P356
10.1063/1.4811712
P407
P577
2013-06-01T00:00:00Z