Bathochromic Shift in Green Fluorescent Protein: A Puzzle for QM/MM Approaches.
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Quantum Monte Carlo Treatment of the Charge Transfer and Diradical Electronic Character in a Retinal Chromophore Minimal Model.Long- and Short-Range Electrostatic Fields in GFP Mutants: Implications for Spectral TuningBlue-Shifted Green Fluorescent Protein Homologues Are Brighter than Enhanced Green Fluorescent Protein under Two-Photon Excitation.Conversion of light-energy into molecular strain in the photocycle of the photoactive yellow protein.Molecular Properties by Quantum Monte Carlo: An Investigation on the Role of the Wave Function Ansatz and the Basis Set in the Water Molecule.Optimized Structure and Vibrational Properties by Error Affected Potential Energy SurfacesProtein Field Effect on the Dark State of 11-cis Retinal in Rhodopsin by Quantum Monte Carlo/Molecular Mechanics.On the optical absorption of the anionic GFP chromophore in vacuum, solution, and protein.Properties of reactive oxygen species by quantum Monte Carlo.Kohn-Sham orbitals and potentials from quantum Monte Carlo molecular densities.Combining frozen-density embedding with the conductor-like screening model using Lagrangian techniques for response properties.High-level Ab Initio Absorption Spectra Simulations of Neutral, Anionic and Neutral+ Chromophore of Green Fluorescence Protein Chromophore Models in Gas Phase and Solution.Resolving Electronic Transitions in Synthetic Fluorescent Protein Chromophores by Magnetic Circular Dichroism.A three-state effective Hamiltonian for symmetric cationic diarylmethanes.Analysis of computational models for an accurate study of electronic excitations in GFP.A polarizable embedding DFT study of one-photon absorption in fluorescent proteins.Electrostatic spectral tuning mechanism of the green fluorescent protein.A two-state model of twisted intramolecular charge-transfer in monomethine dyes.Optimizing conical intersections of solvated molecules: the combined spin-flip density functional theory/effective fragment potential method.The mechanism of a green fluorescent protein proton shuttle unveiled in the time-resolved frequency domain by excited state ab initio dynamics.Multi-level quantum Monte Carlo wave functions for complex reactions: the decomposition of α-hydroxy-dimethylnitrosamine.Modeling environment effects on spectroscopies through QM/classical models
P2860
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P2860
Bathochromic Shift in Green Fluorescent Protein: A Puzzle for QM/MM Approaches.
description
2011 nî lūn-bûn
@nan
2011 թուականի Դեկտեմբերին հրատարակուած գիտական յօդուած
@hyw
2011 թվականի դեկտեմբերին հրատարակված գիտական հոդված
@hy
2011年の論文
@ja
2011年論文
@yue
2011年論文
@zh-hant
2011年論文
@zh-hk
2011年論文
@zh-mo
2011年論文
@zh-tw
2011年论文
@wuu
name
Bathochromic Shift in Green Fluorescent Protein: A Puzzle for QM/MM Approaches.
@ast
Bathochromic Shift in Green Fluorescent Protein: A Puzzle for QM/MM Approaches.
@en
type
label
Bathochromic Shift in Green Fluorescent Protein: A Puzzle for QM/MM Approaches.
@ast
Bathochromic Shift in Green Fluorescent Protein: A Puzzle for QM/MM Approaches.
@en
prefLabel
Bathochromic Shift in Green Fluorescent Protein: A Puzzle for QM/MM Approaches.
@ast
Bathochromic Shift in Green Fluorescent Protein: A Puzzle for QM/MM Approaches.
@en
P356
P1476
Bathochromic Shift in Green Fluorescent Protein: A Puzzle for QM/MM Approaches.
@en
P2093
Claudia Filippi
Francesco Buda
P304
P356
10.1021/CT200704K
P577
2011-12-06T00:00:00Z