Switch branches/tags
Nothing to show
Find file History
Fetching latest commit…
Cannot retrieve the latest commit at this time.
Permalink
..
Failed to load latest commit information.
OrdParPOPC_rep_1.dat
OrdParPOPC_rep_2.dat
OrdParPOPS_rep_1.dat
OrdParPOPS_rep_2.dat
POPC_order.dat
README.md
electron_density.out
number_density.out

README.md

Data from http://doi.org/10.5281/zenodo.1227272

by Batuhan Kav http://nmrlipids.blogspot.com/2017/03/nmrlipids-iv-headgroup-glycerol.html?showComment=1524581650542#c4627966291656120911

wget https://zenodo.org/record/1227272/files/PCPS-KCl4000_rep1.nc wget https://zenodo.org/record/1227272/files/PCPS-NaCl4000mm.prmtop

mv PCPS-KCl4000_rep1.nc ncFILE.nc mv PCPS-NaCl4000mm.prmtop prmtopFILE.prmtop

python2.7 ../../../../../scripts/calcOrderParameters.py -i order_parameter_definitions_Lipid14_DOPS.def -t prmtopFILE.prmtop -x ncFILE.nc -o OrdParsPOPS.dat python2.7 ../../../../../scripts/calcOrderParameters.py -i order_parameter_definitions_POPC.dat -t prmtopFILE.prmtop -x ncFILE.nc -o OrdParsPOPC.dat