000 01255 a2200337 4500
005 20250517063327.0
264 0 _c20160909
008 201609s 0 0 eng d
022 _a1549-9626
024 7 _a10.1021/ct501053x
_2doi
040 _aNLM
_beng
_cNLM
100 1 _aDomene, Carmen
245 0 0 _aBias-Exchange Metadynamics Simulations: An Efficient Strategy for the Analysis of Conduction and Selectivity in Ion Channels.
_h[electronic resource]
260 _bJournal of chemical theory and computation
_cApr 2015
300 _a1896-906 p.
_bdigital
500 _aPublication Type: Journal Article; Research Support, Non-U.S. Gov't
650 0 4 _aAlgorithms
650 0 4 _aArcobacter
_xmetabolism
650 0 4 _aBacterial Proteins
_xchemistry
650 0 4 _aDatabases, Protein
650 0 4 _aIons
_xchemistry
650 0 4 _aMolecular Dynamics Simulation
650 0 4 _aPotassium
_xchemistry
650 0 4 _aSodium
_xchemistry
650 0 4 _aSodium Channels
_xchemistry
650 0 4 _aThermodynamics
700 1 _aBarbini, Paolo
700 1 _aFurini, Simone
773 0 _tJournal of chemical theory and computation
_gvol. 11
_gno. 4
_gp. 1896-906
856 4 0 _uhttps://doi.org/10.1021/ct501053x
_zAvailable from publisher's website
999 _c25453930
_d25453930