These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.
144 related articles for article (PubMed ID: 26797317)
1. Electronically excited states of cob(ii)alamin: insights from CASSCF/XMCQDPT2 and TD-DFT calculations. Garabato BD; Kumar N; Lodowski P; Jaworska M; Kozlowski PM Phys Chem Chem Phys; 2016 Feb; 18(6):4513-26. PubMed ID: 26797317 [TBL] [Abstract][Full Text] [Related]
2. Cob(I)alamin: insight into the nature of electronically excited states elucidated via quantum chemical computations and analysis of absorption, CD and MCD data. Kornobis K; Ruud K; Kozlowski PM J Phys Chem A; 2013 Feb; 117(5):863-76. PubMed ID: 23281629 [TBL] [Abstract][Full Text] [Related]
3. Electronically excited states of vitamin B12: benchmark calculations including time-dependent density functional theory and correlated ab initio methods. Kornobis K; Kumar N; Wong BM; Lodowski P; Jaworska M; Andruniów T; Ruud K; Kozlowski PM J Phys Chem A; 2011 Feb; 115(7):1280-92. PubMed ID: 21280654 [TBL] [Abstract][Full Text] [Related]
4. Role of the Axial Base in the Modulation of the Cob(I)alamin Electronic Properties: Insight from QM/MM, DFT, and CASSCF Calculations. Kumar N; Alfonso-Prieto M; Rovira C; Lodowski P; Jaworska M; Kozlowski PM J Chem Theory Comput; 2011 May; 7(5):1541-51. PubMed ID: 26610143 [TBL] [Abstract][Full Text] [Related]
5. Photodissociation of Co-C bond in methyl- and ethylcobalamin: an insight from TD-DFT calculations. Lodowski P; Jaworska M; Andruniów T; Kumar M; Kozlowski PM J Phys Chem B; 2009 May; 113(19):6898-909. PubMed ID: 19374399 [TBL] [Abstract][Full Text] [Related]
6. Electronic structure of one-electron-oxidized form of the methylcobalamin cofactor: spin density distribution and pseudo-Jahn-teller effect. Kumar N; Kuta J; Galezowski W; Kozlowski PM Inorg Chem; 2013 Feb; 52(4):1762-71. PubMed ID: 23360322 [TBL] [Abstract][Full Text] [Related]
7. Electronic structure of the S1 state in methylcobalamin: insight from CASSCF/MC-XQDPT2, EOM-CCSD, and TD-DFT calculations. Kornobis K; Kumar N; Lodowski P; Jaworska M; Piecuch P; Lutz JJ; Wong BM; Kozlowski PM J Comput Chem; 2013 May; 34(12):987-1004. PubMed ID: 23335227 [TBL] [Abstract][Full Text] [Related]
8. Photolytic properties of cobalamins: a theoretical perspective. Kozlowski PM; Garabato BD; Lodowski P; Jaworska M Dalton Trans; 2016 Mar; 45(11):4457-70. PubMed ID: 26865262 [TBL] [Abstract][Full Text] [Related]
10. Electronically excited states of vitamin B12 and methylcobalamin: theoretical analysis of absorption, CD, and MCD data. Solheim H; Kornobis K; Ruud K; Kozlowski PM J Phys Chem B; 2011 Feb; 115(4):737-48. PubMed ID: 21171660 [TBL] [Abstract][Full Text] [Related]
11. Time-dependent density functional theory study of cobalt corrinoids: Electronically excited states of methylcobalamin. Andruniów T; Jaworska M; Lodowski P; Zgierski MZ; Dreos R; Randaccio L; Kozlowski PM J Chem Phys; 2008 Aug; 129(8):085101. PubMed ID: 19044851 [TBL] [Abstract][Full Text] [Related]
12. Axial solvent coordination in "base-fff" cob(II)alamin and related co(II)-corrinates revealed by 2D-EPR. Van Doorslaer S; Jeschke G; Epel B; Goldfarb D; Eichel RA; Kräutler B; Schweiger A J Am Chem Soc; 2003 May; 125(19):5915-27. PubMed ID: 12733932 [TBL] [Abstract][Full Text] [Related]
13. Spectroscopic and computational characterization of the base-off forms of cob(II)alamin. Liptak MD; Fleischhacker AS; Matthews RG; Telser J; Brunold TC J Phys Chem B; 2009 Apr; 113(15):5245-54. PubMed ID: 19298066 [TBL] [Abstract][Full Text] [Related]
14. Square-antiprismatic eight-coordinate complexes of divalent first-row transition metal cations: a density functional theory exploration of the electronic-structural landscape. Conradie J; Patra AK; Harrop TC; Ghosh A Inorg Chem; 2015 Feb; 54(4):1375-83. PubMed ID: 25574575 [TBL] [Abstract][Full Text] [Related]
15. Excited state electron transfer after visible light absorption by the Co(I) state of vitamin B12. Achey D; Brigham EC; DiMarco BN; Meyer GJ Chem Commun (Camb); 2014 Nov; 50(87):13304-6. PubMed ID: 25232558 [TBL] [Abstract][Full Text] [Related]
16. Spin-flip time dependent density functional theory applied to excited states with single, double, or mixed electron excitation character. Rinkevicius Z; Vahtras O; Agren H J Chem Phys; 2010 Sep; 133(11):114104. PubMed ID: 20866123 [TBL] [Abstract][Full Text] [Related]
17. Cob(II)alamin: Relativistic DFT Analysis of the EPR Parameters. Demissie TB; Repisky M; Liu H; Ruud K; Kozlowski PM J Chem Theory Comput; 2014 May; 10(5):2125-36. PubMed ID: 26580539 [TBL] [Abstract][Full Text] [Related]
18. Re and Br X-ray absorption near-edge structure study of the ground and excited states of [ReBr(CO)3(bpy)] interpreted by DFT and TD-DFT calculations. Záliš S; Milne CJ; El Nahhas A; Blanco-Rodríguez AM; van der Veen RM; Vlček A Inorg Chem; 2013 May; 52(10):5775-85. PubMed ID: 23631457 [TBL] [Abstract][Full Text] [Related]
19. Electronic structure of Cob(I)alamin: the story of an unusual nucleophile. Jensen KP J Phys Chem B; 2005 May; 109(20):10505-12. PubMed ID: 16852272 [TBL] [Abstract][Full Text] [Related]
20. Electronic and structural properties of low-lying excited states of vitamin B12. Lodowski P; Jaworska M; Kornobis K; Andruniów T; Kozlowski PM J Phys Chem B; 2011 Nov; 115(45):13304-19. PubMed ID: 21894986 [TBL] [Abstract][Full Text] [Related] [Next] [New Search]