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Lista de obras de Bo Durbeej

Anabaena sensory rhodopsin is a light-driven unidirectional rotor

artículo científico publicado en 2010

Calculation of Free-Energy Barriers with TD-DFT: A Case Study on Excited-State Proton Transfer in Indigo

artículo científico publicado en 2019

Computational Insight to Improve the Thermal Isomerisation Performance of Overcrowded Alkene-Based Molecular Motors through Structural Redesign

artículo científico publicado en 2016

Distinguishing between keto-enol and acid-base forms of firefly oxyluciferin through calculation of excited-state equilibrium constants.

artículo científico publicado en 2014

Electron-transfer induced repair of 6-4 photoproducts in DNA: a computational study

artículo científico publicado en 2007

Excited-State Aromaticity Improves Molecular Motors: A Computational Analysis

artículo científico publicado en 2017

Excited-state modeling of the astaxanthin dimer predicts a minor contribution from exciton coupling to the bathochromic shift in crustacyanin.

artículo científico publicado en 2009

How accurate are TD-DFT excited-state geometries compared to DFT ground-state geometries?

scientific article published on 23 April 2020

How method-dependent are calculated differences between vertical, adiabatic, and 0-0 excitation energies?

artículo científico publicado en 2014

Initial excited-state relaxation of the bilin chromophores of phytochromes: a computational study.

artículo científico publicado en 2011

Inter-Excited-State Phosphorescence in the Four-Component Relativistic Kohn-Sham Approximation: A Case Study on Lumiflavin

artículo científico publicado en 2015

Intramolecular Proton and Charge Transfer of Pyrene-based trans-Stilbene Salicylic Acids Applied to Detection of Aggregated Proteins

artículo científico publicado en 2018

Light-driven rotary molecular motors without point chirality: a minimal design.

artículo científico publicado en 2017

Modeling of phytochrome absorption spectra.

artículo científico publicado en 2013

Molecular Photoswitching Aided by Excited-State Aromaticity

artículo científico publicado en 2018

On the importance of ribose orientation in the substrate activation of the coenzyme B12-dependent mutases.

artículo científico publicado en 2009

On the origin and variation of colors in lobster carapace

artículo científico publicado en 2015

Photodegradation of substituted stilbene compounds: what colors aging paper yellow?

artículo científico publicado en 2005

Protein-bound chromophores astaxanthin and phytochromobilin: excited state quantum chemical studies.

artículo científico publicado en 2006

Quantum chemical comparison of vertical, adiabatic, and 0-0 excitation energies: the PYP and GFP chromophores.

artículo científico publicado en 2012

Relative ground and excited-state pKa values of phytochromobilin in the photoactivation of phytochrome: a computational study.

artículo científico publicado en 2007

Simulating the Nonadiabatic Relaxation Dynamics of 4-(N,N-Dimethylamino)benzonitrile (DMABN) in Polar Solution

artículo científico publicado en 2020

Steric Effects Govern the Photoactivation of Phytochromes

artículo científico publicado en 2016

The elusive 5'-deoxyadenosyl radical in coenzyme-B12-mediated reactions.

artículo científico publicado en 2012

Theoretical Study of Ground- and Excited-State Charge Transfer in Fulvene-Based Donor-Acceptor Systems

scientific article published on 25 July 2019

Toward Fast and Efficient Visible-Light-Driven Molecular Motors: A Minimal Design

scholarly article by Jun Wang & Bo Durbeej published August 2018 in ChemistryOpen

Unidirectional Rotary Motion in Isotopically Chiral Molecular Motors: A Computational Analysis

artículo científico publicado en 2020

Which factors determine the acidity of the phytochromobilin chromophore of plant phytochrome?

artículo científico publicado en 2008