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DOPS_ff99ions_rep1_order_parameters.out
DOPS_ff99ions_rep1_order_parameters_amber.dat
DOPS_ff99ions_rep2_order_parameters.out
DOPS_ff99ions_rep2_order_parameters_amber.dat
DOPS_jcions_rep1_order_parameters.out
DOPS_jcions_rep1_order_parameters_amber.dat
DOPS_jcions_rep2_order_parameters.out
DOPS_jcions_rep2_order_parameters_amber.dat
DOPSorderparametersLipid17ff99ions1.dat
DOPSorderparametersLipid17ff99ions2.dat
DOPSorderparametersLipid17jcions1.dat
DOPSorderparametersLipid17jcions2.dat
JCions_head-glyc-OPs_ave_min_max.dat
OrdParsDOPS.dat
README.md
head-glyc-OPs_ave_min_max.dat
order_parameter_definitions_Lipid14_DOPS.def

README.md

Data from http://doi.org/10.5281/zenodo.1135142

by Batuhan Kav http://nmrlipids.blogspot.com/2017/03/nmrlipids-iv-headgroup-glycerol.html?showComment=1515078990369#c1155009336153859041

wget https://zenodo.org/record/1135142/files/DOPS_amber_lipid17_ff99ions_prod_rep1.nc wget https://zenodo.org/record/1135142/files/DOPS_amber_lipid17_ff99ions_prod_rep1.restart wget https://zenodo.org/record/1135142/files/DOPS_amber_lipid17_ff99ions.prmtop

python2 ~/work/NMRLipids/MATCH/scratch/scriptsBYmelcr/calcOrderParameters.py -i order_parameter_definitions_Lipid14_DOPS.def -t DOPS_amber_lipid17_ff99ions.prmtop -x DOPS_amber_lipid17_ff99ions_prod_rep1.nc -o OrdParsDOPS.dat

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