000 01278 a2200361 4500
005 20250515173056.0
264 0 _c20090928
008 200909s 0 0 eng d
022 _a1089-7690
024 7 _a10.1063/1.3137054
_2doi
040 _aNLM
_beng
_cNLM
100 1 _aLeung, Kevin
245 0 0 _aAb initio molecular dynamics calculations of ion hydration free energies.
_h[electronic resource]
260 _bThe Journal of chemical physics
_cMay 2009
300 _a204507 p.
_bdigital
500 _aPublication Type: Journal Article; Research Support, N.I.H., Extramural; Research Support, U.S. Gov't, Non-P.H.S.
650 0 4 _aBinding Sites
650 0 4 _aBiomechanical Phenomena
650 0 4 _aCatalysis
650 0 4 _aComputational Biology
650 0 4 _aModels, Chemical
650 0 4 _aModels, Statistical
650 0 4 _aPhysical Phenomena
650 0 4 _aPotassium Chloride
_xchemistry
650 0 4 _aSubstrate Specificity
650 0 4 _aTemperature
650 0 4 _aThermodynamics
650 0 4 _aWater
_xchemistry
700 1 _aRempe, Susan B
700 1 _avon Lilienfeld, O Anatole
773 0 _tThe Journal of chemical physics
_gvol. 130
_gno. 20
_gp. 204507
856 4 0 _uhttps://doi.org/10.1063/1.3137054
_zAvailable from publisher's website
999 _c18910314
_d18910314