Structure of condensed phase peptides: insights from vibrational circular dichroism and Raman optical activity techniques

TA Keiderling - Chemical reviews, 2020 - ACS Publications
Peptides and proteins are naturally chiral molecular systems so that sensing their structure
and conformation with chirality-based spectral methods is an obvious and long-used …

How to get insight into amyloid structure and formation from infrared spectroscopy

SD Moran, MT Zanni - The journal of physical chemistry letters, 2014 - ACS Publications
There is an enormous amount of interest in the structures and formation mechanisms of
amyloid fibers. In this Perspective, we review the most common structural motifs of amyloid …

Chirality induction and amplification in supramolecular systems exhibiting vibrational optical activity

A Kaczor - Physical Chemistry Chemical Physics, 2023 - pubs.rsc.org
Vibrational optical activity (VOA) refers to two vibrational techniques: vibrational circular
dichroism (VCD) and Raman optical activity (ROA) that are sensitive both to the chirality and …

[图书][B] Chiroptical spectroscopy: fundamentals and applications

PL Polavarapu - 2016 - taylorfrancis.com
This book details chiroptical spectroscopic methods: electronic circular dichroism (ECD),
optical rotatory dispersion (ORD), vibrational circular dichroism (VCD), and vibrational …

Vibrational approach to the dynamics and structure of protein amyloids

H Li, R Lantz, D Du - Molecules, 2019 - mdpi.com
Amyloid diseases, including neurodegenerative diseases such as Alzheimer's and
Parkinson's, are linked to a poorly understood progression of protein misfolding and …

A computational protocol for vibrational circular dichroism spectra of cyclic oligopeptides

KDR Eikås, MTP Beerepoot… - The Journal of Physical …, 2022 - ACS Publications
Cyclic peptides are a promising class of compounds for next-generation antibiotics as they
may provide new ways of limiting antibiotic resistance development. Although their cyclic …

A free energy barrier caused by the refolding of an oligomeric intermediate controls the lag time of amyloid formation by hIAPP

AL Serrano, JP Lomont, LH Tu… - Journal of the …, 2017 - ACS Publications
Transiently populated oligomers formed en route to amyloid fibrils may constitute the most
toxic aggregates associated with many amyloid-associated diseases. Most nucleation …

Vibrational Optical Activity of amyloid fibrils

Z Majka, K Kwiecień, A Kaczor - ChemPlusChem, 2024 - Wiley Online Library
Amyloid fibrils are supramolecular systems showing distinct chirality at different levels of
their complex multilayered architectures. Due to the regular long‐range chiral organization …

Efficient calculation of anharmonic vibrational spectra of large molecules with localized modes

PT Panek, CR Jacob - ChemPhysChem, 2014 - Wiley Online Library
The analysis and interpretation of the vibrational spectra of complex (bio) molecular
systems, such as polypeptides and proteins, requires support from quantum‐chemical …

The Phenomenon of Vibrational Circular Dichroism Enhancement: A Systematic Survey of Literature Data

G Pescitelli, L Di Bari - The Journal of Physical Chemistry B, 2024 - ACS Publications
While the intensity of vibrational circular dichroism (VCD) signals is commonly 104–105
times smaller than that of corresponding IR signals, several kinds of systems display …