AbstractWe report a 1.4-ns constant-pressure molecular dynamics simulation of cholesterol at 12.5 mol% in a dipalmitoylphosphatidylcholine (DPPC) bilayer at 50°C and compare the results to our previous simulation of a pure DPPC bilayer. The interlamellar spacing was increased by 2.5Å in the cholesterol-containing bilayer, consistent with x-ray diffraction results, whereas the bilayer thickness was increased by only 1Å. The bilayer/water interface was more abrupt because the lipid headgroups lie flatter to fill spaces left by the cholesterol molecules. This leads to less compensation by the lipid headgroups of the oriented water contribution to the membrane dipole potential and could explain the experimentally observed increase in the magnit...
AbstractA 15-ns molecular dynamics (MD) simulation of the fully hydrated dimyristoylphosphatidylchol...
We employ 100-ns molecular dynamics simulations to study the influence of cholesterol on structural ...
ABSTRACT A molecular dynamics (MD) simulation of a fully hydrated, liquid-crystalline dimyristoylpho...
AbstractWe report a 1.4-ns constant-pressure molecular dynamics simulation of cholesterol at 12.5 mo...
AbstractTo investigate the microscopic interactions between cholesterol and lipids in biological mem...
By using molecular dynamics simulation technique we studied the changes occurring in membranes const...
AbstractUsing the molecular dynamics simulation technique, we studied the changes occurring in a dip...
By means of atomistic molecular dynamics simulations, we study cholesterol-DPPC (dipalmitoyl phospha...
AbstractA 15-ns molecular dynamics simulation of the fully hydrated liquid–crystalline dimyristoylph...
AbstractWe employ 100-ns molecular dynamics simulations to study the influence of cholesterol on str...
ABSTRACT A 15-ns molecular dynamics (MD) simulation of the fully hydrated dimyristoylphosphatidylcho...
Using the molecular dynamics simulation technique, we studied the changes occurring in a dipalmitoyl...
Using the molecular dynamics simulation technique, we studied the changes occurring in a dipalmitoyl...
AbstractUsing the molecular dynamics simulation technique, we studied the changes occurring in a dip...
AbstractA molecular dynamics (MD) simulation of a fully hydrated, liquid-crystalline dimyristoylphos...
AbstractA 15-ns molecular dynamics (MD) simulation of the fully hydrated dimyristoylphosphatidylchol...
We employ 100-ns molecular dynamics simulations to study the influence of cholesterol on structural ...
ABSTRACT A molecular dynamics (MD) simulation of a fully hydrated, liquid-crystalline dimyristoylpho...
AbstractWe report a 1.4-ns constant-pressure molecular dynamics simulation of cholesterol at 12.5 mo...
AbstractTo investigate the microscopic interactions between cholesterol and lipids in biological mem...
By using molecular dynamics simulation technique we studied the changes occurring in membranes const...
AbstractUsing the molecular dynamics simulation technique, we studied the changes occurring in a dip...
By means of atomistic molecular dynamics simulations, we study cholesterol-DPPC (dipalmitoyl phospha...
AbstractA 15-ns molecular dynamics simulation of the fully hydrated liquid–crystalline dimyristoylph...
AbstractWe employ 100-ns molecular dynamics simulations to study the influence of cholesterol on str...
ABSTRACT A 15-ns molecular dynamics (MD) simulation of the fully hydrated dimyristoylphosphatidylcho...
Using the molecular dynamics simulation technique, we studied the changes occurring in a dipalmitoyl...
Using the molecular dynamics simulation technique, we studied the changes occurring in a dipalmitoyl...
AbstractUsing the molecular dynamics simulation technique, we studied the changes occurring in a dip...
AbstractA molecular dynamics (MD) simulation of a fully hydrated, liquid-crystalline dimyristoylphos...
AbstractA 15-ns molecular dynamics (MD) simulation of the fully hydrated dimyristoylphosphatidylchol...
We employ 100-ns molecular dynamics simulations to study the influence of cholesterol on structural ...
ABSTRACT A molecular dynamics (MD) simulation of a fully hydrated, liquid-crystalline dimyristoylpho...