about
Gramicidin A channel as a test ground for molecular dynamics force fieldsPosition of the third Na+ site in the aspartate transporter GltPh and the human glutamate transporter, EAAT1.Importance of the peptide backbone description in modeling the selectivity filter in potassium channels.Physics of ion channels.All-electron relativistic Dirac-Fock-Slater self-consistent-field calculations of the singly charged diatomic transition-metal- (Fe, Co, Ni, Cu, Zn) argon molecules.Relativistic ab initio interpretation of L-K vacancy sharing in ion-solid-target collisionsTarget-electronic-structure dependence in highly-charged-ion-C60 collisionsFree energy simulations of single and double ion occupancy in gramicidin ABinding of organic cations to gramicidin A channel studied with AutoDock and molecular dynamics simulationsPotential of mean force calculations of ligand binding to ion channels from Jarzynski's equality and umbrella samplingTest of molecular dynamics force fields in gramicidin ARelativistic effects on the electronic structure and volatility of group-8 tetroxides MO4, where M=Ru, Os, and element 108, HsMolecular dynamics simulations of gramicidin A in a lipid bilayer: from structure-function relations to force fields
P50
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P50
description
researcher
@en
wetenschapper
@nl
name
Turgut Baştuğ
@en
Turgut Baştuğ
@nl
type
label
Turgut Baştuğ
@en
Turgut Baştuğ
@nl
prefLabel
Turgut Baştuğ
@en
Turgut Baştuğ
@nl
P106
P31
P496
0000-0001-9123-9292