Related references
Note: Only part of the references are listed.Two-dimensional infrared population transfer spectroscopy for enhancing structural markers of proteins
Thomas La Cour Jansen et al.
BIOPHYSICAL JOURNAL (2008)
Vibrational relaxation in simulated two-dimensional infrared spectra of two amide modes in solution
Arend G. Dijkstra et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Dynamics of a multimode system coupled to multiple heat baths probed by two-dimensional infrared spectroscopy
Akihito Ishizaki et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Two-dimensional spectroscopy at infrared and optical frequencies
Robin M. Hochstrasser
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2007)
Quantum dynamics of N-methylacetamide studied by the vibrational configuration interaction method
Hiroshi Fujisaki et al.
CHEMICAL PHYSICS LETTERS (2007)
Time-domain calculations of the infrared and polarized Raman spectra of tetraalanine in aqueous solution
Hajime Torii
JOURNAL OF PHYSICAL CHEMISTRY B (2007)
Ab initio based building block model of amide I vibrations in peptides
Roman D. Gorbunov et al.
CHEMICAL PHYSICS LETTERS (2007)
Two-dimensional infrared spectral signatures of 310- and α-helical peptides
Hiroaki Maekawa et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2007)
Quantum-classical description of the amide I vibrational spectrum of trialanine
Roman D. Gorbunov et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Infrared spectroscopy of proteins
Andreas Barth
BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS (2007)
Nonadiabatic effects in the two-dimensional infrared spectra of peptides: Application to alanine dipeptide
Thomas la Cour Jansen et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2006)
Spectral signatures of heterogeneous protein ensembles revealed by MD simulations of 2DIR spectra
Ziad Ganim et al.
BIOPHYSICAL JOURNAL (2006)
The anharmonic vibrational potential and relaxation pathways of the amide I and II modes of N-methylacetamide
Lauren P. DeFlores et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2006)
Modeling vibrational dephasing and energy relaxation of intramolecular anharmonic modes for multidimensional infrared spectroscopies
Akihito Ishizaki et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Modeling the amide I bands of small peptides
Thomas la Cour Jansen et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Time-dependent perturbation theory for vibrational energy relaxation and dephasing in peptides and proteins
H Fujisaki et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Effects of intermolecular vibrational coupling and liquid dynamics on the polarized Raman and two-dimensional infrared spectral profiles of liquid N,N-dimethylformamide analyzed with a time-domain computational method
H Torii
JOURNAL OF PHYSICAL CHEMISTRY A (2006)
Simulation protocols for coherent femtosecond vibrational spectra of peptides
W Zhuang et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2006)
A transferable electrostatic map for solvation effects on amide I vibrations and its application to linear and two-dimensional spectroscopy
TL Jansen et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Electrostatic DFT map for the complete vibrational amide band of NMA
T Hayashi et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2005)
Pronounced non-Condon effects in the ultrafast infrared spectroscopy of water
JR Schmidt et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Simulation studies of amide IIR absorption and two-dimensional IR spectra of β hairpins in liquid water
S Hahn et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
Amide I vibrational dynamics of N-methylacetamide in polar solvents:: The role of electrostatic interactions
MF DeCamp et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
Collective oscillations and the linear and two-dimensional infrared spectra of inhomogeneous β-sheets
AG Dijkstra et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
Hydrogen-bonded acetic acid dimers: Anharmonic coupling and linear infrared spectra studied with density-functional theory
J Dreyer
JOURNAL OF CHEMICAL PHYSICS (2005)
Empirical solvent correction for multiple amide group vibrational modes -: art. no. 144501
P Bour et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Combined electronic structure/molecular dynamics approach for ultrafast infrared spectroscopy of dilute HOD in liquid H2O and D2O
SA Corcelli et al.
JOURNAL OF CHEMICAL PHYSICS (2004)
Vibrational interactions in the amide I subspace of the oligomers and hydration clusters of N-methylacetamide
H Torii
JOURNAL OF PHYSICAL CHEMISTRY A (2004)
Stochastic Liouville equation simulation of multidimensional vibrational line shapes of trialanine
TL Jansen et al.
JOURNAL OF CHEMICAL PHYSICS (2004)
Amide I modes of α-helical polypeptide in liquid water:: Conformational fluctuation, phase correlation, and linear and nonlinear vibrational spectra
S Ham et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2004)
Two-dimensional infrared spectroscopy of antiparallel β-sheet secondary structure
N Demirdöven et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2004)
Ultrafast vibrational spectroscopy of water and aqueous N-methylacetamide:: Comparison of different electronic structure/molecular dynamics approaches
JR Schmidt et al.
JOURNAL OF CHEMICAL PHYSICS (2004)
Empirical modeling of the peptide amide I band IR intensity in water solution
P Bour et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Ultrafast hydrogen-bond dynamics in the infrared spectroscopy of water
CJ Fecko et al.
SCIENCE (2003)
Local amide I mode frequencies and coupling constants in polypeptides
JH Choi et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2003)
Molecular dynamics simulation study of N-methylacetamide in water.: I.: Amide I mode frequency fluctuation
K Kwac et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Dual-frequency 2D-IR spectroscopy heterodyned photon echo of the peptide bond
IV Rubtsov et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2003)
Dual frequency 2D-IR of peptide amide-A and amide-I modes
IV Rubtsov et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Amide I modes in the N-methylacetamide dimer and glycine dipeptide analog:: Diagonal force constants
S Ham et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Nonequilibrium molecular-dynamics study of the vibrational energy relaxation of peptides in water
PH Nguyen et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Correlated line broadening in multidimensional vibrational spectroscopy
R Venkatramani et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Vibrational dynamics, mode coupling, and structural constraints for acetylproline-NH2
IV Rubtsov et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2002)
Coherent multidimensional vibrational spectroscopy
JC Wright
INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY (2002)
Coupling and orientation between anharmonic vibrations characterized with two-dimensional infrared vibrational echo spectroscopy
O Golonzka et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
Time-resolved two-dimensional vibrational spectroscopy of a short α-helix in water
S Woutersen et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
Dihedral angles of trialanine in D2O determined by combining FTIR and polarized visible Raman spectroscopy
R Schweitzer-Stenner et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2001)
Chemistry with ADF
G te Velde et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2001)
Two-dimensional IR-spectroscopy: polarization anisotropy effects
RM Hochstrasser
CHEMICAL PHYSICS (2001)
Signatures of vibrational interactions in coherent two-dimensional infrared spectroscopy
M Khalil et al.
CHEMICAL PHYSICS (2001)
Isotope-edited two-dimensional vibrational spectroscopy of trialanine in aqueous solution
S Woutersen et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
GROMACS 3.0: a package for molecular simulation and trajectory analysis
E Lindahl et al.
JOURNAL OF MOLECULAR MODELING (2001)
Vibrational energy relaxation and spectral diffusion in water and deuterated water
JC Deàk et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2000)
Share Paper
