Nitrile groups as vibrational probes: calculations of the CN infrared absorption line shape of acetonitrile in water and tetrahydrofuran.
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Site-specific infrared probes of proteinsNitrile Bonds as Infrared Probes of Electrostatics in Ribonuclease SQuantitative, directional measurement of electric field heterogeneity in the active site of ketosteroid isomerase.Probing the Electrostatics of Active Site Microenvironments along the Catalytic Cycle for Escherichia coli Dihydrofolate ReductaseComputational Modeling of the Nitrile Stretching Vibration of 5-Cyanoindole in Water.Site-Specific Spectroscopic Reporters of the Local Electric Field, Hydration, Structure, and Dynamics of Biomolecules.Solvent-induced infrared frequency shifts in aromatic nitriles are quantitatively described by the vibrational Stark effectSite-specific measurement of water dynamics in the substrate pocket of ketosteroid isomerase using time-resolved vibrational spectroscopySolute's perspective on how trimethylamine oxide, urea, and guanidine hydrochloride affect water's hydrogen bonding ability5-Cyanotryptophan as an Infrared Probe of Local Hydration Status of Proteins.Photochemical activity of Titan's low-altitude condensed haze.Vibrational Stark spectroscopy for assessing ligand-binding strengths in a protein.Applications of 2D IR spectroscopy to peptides, proteins, and hydrogen-bond dynamicsSite-specific dynamics of amyloid formation and fibrillar configuration of Aβ(1-23) using an unnatural amino acid.The Two Dimensional Vibrational Echo of a Nitrile Probe of the Villin HP35 Protein.Calculation of vibrational shifts of nitrile probes in the active site of ketosteroid isomerase upon ligand binding.A direct comparison of azide and nitrile vibrational probes2D IR photon echo spectroscopy reveals hydrogen bond dynamics of aromatic nitriles.A solvatochromic model calibrates nitriles' vibrational frequencies to electrostatic fields.Decomposition of vibrational shifts of nitriles into electrostatic and hydrogen-bonding effects.Calculation of the Vibrational Stark Effect Using a First-Principles QM/MM Approach.Vibrational solvatochromism: towards systematic approach to modeling solvation phenomena.Integrated and dispersed photon echo studies of nitrile stretching vibration of 4-cyanophenol in methanol.Carbon-deuterium vibrational probes of peptide conformation: alanine dipeptide and glycine dipeptide.Azido-derivatized compounds as IR probes of local electrostatic environment: Theoretical studies.Water-anion hydrogen bonding dynamics: Ultrafast IR experiments and simulations.Reorientation-induced spectral diffusion of non-isotropic orientation distributions.Car-Parrinello simulation of hydrogen bond dynamics in sodium hydrogen bissulfate.Computational IR spectroscopy of water: OH stretch frequencies, transition dipoles, and intermolecular vibrational coupling constants.Al3+, Ca2+, Mg2+, and Li+ in aqueous solution: calculated first-shell anharmonic OH vibrations at 300 K.Cyanylated Cysteine Reports Site-Specific Changes at Protein-Protein-Binding Interfaces Without Perturbation.Synthesis of 5-Cyano-Tryptophan as a Two-Dimensional Infrared Spectroscopic Reporter of Structure.Functionalization of Graphene with Nitrile Groups by Cycloaddition of Tetracyanoethylene Oxide
P2860
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P2860
Nitrile groups as vibrational probes: calculations of the CN infrared absorption line shape of acetonitrile in water and tetrahydrofuran.
description
2008 nî lūn-bûn
@nan
2008 թուականի Ապրիլին հրատարակուած գիտական յօդուած
@hyw
2008 թվականի ապրիլին հրատարակված գիտական հոդված
@hy
2008年の論文
@ja
2008年論文
@yue
2008年論文
@zh-hant
2008年論文
@zh-hk
2008年論文
@zh-mo
2008年論文
@zh-tw
2008年论文
@wuu
name
Nitrile groups as vibrational ...... in water and tetrahydrofuran.
@ast
Nitrile groups as vibrational ...... in water and tetrahydrofuran.
@en
type
label
Nitrile groups as vibrational ...... in water and tetrahydrofuran.
@ast
Nitrile groups as vibrational ...... in water and tetrahydrofuran.
@en
prefLabel
Nitrile groups as vibrational ...... in water and tetrahydrofuran.
@ast
Nitrile groups as vibrational ...... in water and tetrahydrofuran.
@en
P356
P1476
Nitrile groups as vibrational ...... in water and tetrahydrofuran.
@en
P2093
Beth A Lindquist
Steven A Corcelli
P304
P356
10.1021/JP802039E
P407
P577
2008-04-26T00:00:00Z