Empirical maps for the calculation of amide I vibrational spectra of proteins from classical molecular dynamics simulations.
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Assessment of amide I spectroscopic maps for a gas-phase peptide using IR-UV double-resonance spectroscopy and density functional theory calculationsExploring the role of hydration and confinement in the aggregation of amyloidogenic peptides Aβ(16-22) and Sup35(7-13) in AOT reverse micellesRole of Charge and Solvation in the Structure and Dynamics of Alanine-Rich Peptide AKA2 in AOT Reverse MicellesProbing the dynamics of N-methylacetamide in methanol via ab initio molecular dynamics.Application of two-dimensional infrared spectroscopy to benchmark models for the amide I band of proteins.Interplay between Hydrogen Bonding and Vibrational Coupling in Liquid N-Methylacetamide.Solvent-Independent Anharmonicity for Carbonyl Oscillators.A weight averaged approach for predicting amide vibrational bands of a sphingomyelin bilayer.Effective representation of amide III, II, I, and A modes on local vibrational modes: Analysis of ab initio quantum calculation results.
P2860
Q30363602-5AA3B688-3E5C-49FB-8B6B-6A82B421EBA6Q34642775-5296E60F-A533-478A-92E6-DB451C5CEFC4Q35892829-E5BB6EF4-69A9-4078-B303-2AD9EC89368EQ38805808-536AFD73-2FAE-4D3D-9DAC-8737FDD4D35CQ38998615-EDF76230-3413-4459-841E-834D302F40B4Q42216394-585C0102-83D0-48D2-A77B-0C7D22726897Q46622382-661E60F6-F536-4916-9B1F-177B62489CAAQ47354703-B19AE93D-6379-435F-ABAE-BB51AE598155Q51350723-99C58282-D050-449C-822E-3192B8E29143
P2860
Empirical maps for the calculation of amide I vibrational spectra of proteins from classical molecular dynamics simulations.
description
2014 nî lūn-bûn
@nan
2014 թուականի Ապրիլին հրատարակուած գիտական յօդուած
@hyw
2014 թվականի ապրիլին հրատարակված գիտական հոդված
@hy
2014年の論文
@ja
2014年論文
@yue
2014年論文
@zh-hant
2014年論文
@zh-hk
2014年論文
@zh-mo
2014年論文
@zh-tw
2014年论文
@wuu
name
Empirical maps for the calcula ...... olecular dynamics simulations.
@ast
Empirical maps for the calcula ...... olecular dynamics simulations.
@en
type
label
Empirical maps for the calcula ...... olecular dynamics simulations.
@ast
Empirical maps for the calcula ...... olecular dynamics simulations.
@en
prefLabel
Empirical maps for the calcula ...... olecular dynamics simulations.
@ast
Empirical maps for the calcula ...... olecular dynamics simulations.
@en
P2860
P356
P1476
Empirical maps for the calcula ...... olecular dynamics simulations.
@en
P2093
Edyta Małolepsza
John E Straub
P2860
P304
P356
10.1021/JP412827S
P407
P577
2014-04-11T00:00:00Z