000 01189 a2200325 4500
005 20250517104046.0
264 0 _c20180418
008 201804s 0 0 eng d
022 _a1520-5207
024 7 _a10.1021/acs.jpcb.6b02701
_2doi
040 _aNLM
_beng
_cNLM
100 1 _aJohnston, Ryne C
245 0 0 _aToward Quantitatively Accurate Calculation of the Redox-Associated Acid-Base and Ligand Binding Equilibria of Aquacobalamin.
_h[electronic resource]
260 _bThe journal of physical chemistry. B
_c08 2016
300 _a7307-18 p.
_bdigital
500 _aPublication Type: Journal Article; Research Support, U.S. Gov't, Non-P.H.S.
650 0 4 _aKinetics
650 0 4 _aLigands
650 0 4 _aModels, Molecular
650 0 4 _aOxidation-Reduction
650 0 4 _aQuantum Theory
650 0 4 _aThermodynamics
650 0 4 _aVitamin B 12
_xanalogs & derivatives
650 0 4 _aWater
_xchemistry
700 1 _aZhou, Jing
700 1 _aSmith, Jeremy C
700 1 _aParks, Jerry M
773 0 _tThe journal of physical chemistry. B
_gvol. 120
_gno. 30
_gp. 7307-18
856 4 0 _uhttps://doi.org/10.1021/acs.jpcb.6b02701
_zAvailable from publisher's website
999 _c26203445
_d26203445