Related references
Note: Only part of the references are listed.Resonance Raman investigation of dithionite-reduced cobalamin
Kaoru Mieda-Higa et al.
JOURNAL OF RAMAN SPECTROSCOPY (2020)
Ultrafast Excited State Dynamics and Fluorescence from Vitamin B12 and Organometallic [Co]-C≡C-R Cobalamins
Elvin Salerno et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2020)
Can photolysis of the Co-C bond in coenzyme B12-dependent enzymes be used to mimic the native reaction?
Abdullah Al Mamun et al.
JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY B-BIOLOGY (2019)
Three Dimensional Triply Resonant Sum Frequency Spectroscopy Revealing Vibronic Coupling in Cobalamins: Toward a Probe of Reaction Coordinates
Jonathan D. Handali et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2018)
Resonance Raman spectroscopic study of the interaction between Co(II)rrinoids and the ATP:corrinoid adenosyltransferase PduO from Lactobacillus reuteri
Kiyoung Park et al.
JOURNAL OF BIOLOGICAL INORGANIC CHEMISTRY (2016)
Spectroscopic and Computational Studies of Cobalamin Species with Variable Lower Axial Ligation: Implications for the Mechanism of Co-C Bond Activation by Class I Cobalamin-Dependent Isomerases
Karen S. Conrad et al.
INORGANIC CHEMISTRY (2015)
Spectral and Electronic Properties of Nitrosylcobalamin
Ivan G. Pallares et al.
INORGANIC CHEMISTRY (2014)
Cob(I)alamin: Insight Into the Nature of Electronically Excited States Elucidated via Quantum Chemical Computations and Analysis of Absorption, CD and MCD Data
Karina Kornobis et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2013)
Combined Spectroscopic and Computational Analysis of the Vibrational Properties of Vitamin B12 in its Co3+, Co2+, and Co1+ Oxidation States
Kiyoung Park et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2013)
Combined Spectroscopic/Computational Studies of Vitamin B12 Precursors: Geometric and Electronic Structures of Cobinamides
Amanda J. Reig et al.
INORGANIC CHEMISTRY (2012)
The Cobalt-Methyl Bond Dissociation in Methylcobalamin: New Benchmark Analysis Based on Density Functional Theory and Completely Renormalized Coupled-Cluster Calculations
Pawel M. Kozlowski et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2012)
cis Influence in Models of Cobalt Corrins by DFT and TD-DFT Studies
Isabelle Navizet et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2012)
The ORCA program system
Frank Neese
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE (2012)
Spectroscopic and Computational Studies of Glutathionylcobalamin: Nature of Co-S Bonding and Comparison to Co-C Bonding in Coenzyme B12
Karen S. Conrad et al.
INORGANIC CHEMISTRY (2011)
Electronically Excited States of Vitamin B12: Benchmark Calculations Including Time-Dependent Density Functional Theory and Correlated ab Initio Methods
Karina Kornobis et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2011)
Electronically Excited States of Vitamin B12 and Methylcobalamin: Theoretical Analysis of Absorption, CD, and MCD Data
Harald Solheim et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2011)
Electronic and Structural Properties of Low-lying Excited States of Vitamin B12
Piotr Lodowski et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2011)
Spectroscopically validated density functional theory studies of the B-12 cofactors and their interactions with enzyme active sites
Thomas C. Brunold et al.
COORDINATION CHEMISTRY REVIEWS (2009)
Cobalamins uncovered by modern electronic structure calculations
Kasper P. Jensen et al.
COORDINATION CHEMISTRY REVIEWS (2009)
High Resolution Crystal Structure of the Methylcobalamin Analogues Ethylcobalamin and Butylcobalamin by X-ray Synchrotron Diffraction
Luciana Hannibal et al.
INORGANIC CHEMISTRY (2009)
Time-dependent density functional theory study of cobalt corrinoids: Electronically excited states of coenzyme B12
Tadeusz Andruniow et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Time-dependent density functional theory study of cobalt corrinoids:: Electronically excited states of methylcobalamin
Tadeusz Andruniow et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
Analysis and prediction of absorption band shapes, fluorescence band shapes, resonance Raman intensities, and excitation profiles using the time-dependent theory of electronic spectroscopy
Taras Petrenko et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Performance of DFT in modeling electronic and structural properties of cobalamins
Jadwiga Kuta et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2006)
DFT analysis of Co-alkyl and Co-adenosyl vibrational modes in B12-cofactors
Pawel M. Kozlowski et al.
INORGANIC CHEMISTRY (2006)
Electronic structure studies of the adenosylcobalamin cofactor in glutamate mutase
AJ Brooks et al.
BIOCHEMISTRY (2005)
Chemistry and enzymology of vitamin B12
KL Brown
CHEMICAL REVIEWS (2005)
Accurate redetermination of the X-ray structure and electronic bonding in adenosylcobalamin
LZ Ouyang et al.
INORGANIC CHEMISTRY (2004)
Theoretical prediction of the Co-C bond strength in cobalamins
KP Jensen et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2003)
Electronic spectrum of Co-corrin calculated with the TDDFT method
M Jaworska et al.
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM (2003)
Radical carbon skeleton rearrangements:: Catalysis by coenzyme B12-dependent mutases
R Banerjee
CHEMICAL REVIEWS (2003)
Spectroscopic and computational studies of Co3+-corrinoids:: Spectral and electronic properties of the B12 cofactors and biologically relevant precursors
TA Stich et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2003)
Vibrational analysis of methylcobalamin
T Andruniow et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2002)
Quantum chemical modeling of Co-C bond activation in B12-dependent enzymes
PM Kozlowski
CURRENT OPINION IN CHEMICAL BIOLOGY (2001)
Parameters for the AMBER force field for the molecular mechanics modeling of the cobalt corrinoids
HM Marques et al.
JOURNAL OF MOLECULAR STRUCTURE (2001)
Theoretical determination of the Co-C bond energy dissociation in cobalamins
T Andruniow et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2001)
DFT-SQM force field for cobalt corrinoids
T Andruniow et al.
CHEMICAL PHYSICS LETTERS (2000)
Distal interactions in the cyanide complex of ferric Chlamydomonas hemoglobin
TK Das et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2000)
Similarities and differences between cobalamins and cobaloximes. Accurate structural determination of methylcobalamin and of LiCl- and KCl-containing cyanocobalamins by synchrotron radiation
L Randaccio et al.
INORGANIC CHEMISTRY (2000)