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README.md

Data from http://doi.org/10.5281/zenodo.3613573

#wget https://zenodo.org/record/3613573/files/PCPG_CA1000_extend.xtc #wget https://zenodo.org/record/3613573/files/PCPG_CA1000.tpr #wget https://zenodo.org/record/3613573/files/PCPG_CA1000_extend.gro

mv PCPG_CA1000.tpr topol.tpr echo System | gmx trjconv -f PCPG_CA1000_extend.xtc -o traj.xtc -s topol.tpr -b 1000000 mv PCPG_CA1000_extend.gro conf.gro

cp ../../../../../scripts/orderParm_defs/order_parameter_definitions_slipids_POPC_all.def defFILE.def sh ../../../../../scripts/order_parameters_calculate.sh mv OrdPars.dat OrdParsPOPC.dat

cp ../../../../../scripts/orderParm_defs/order_parameter_definitions_MODEL_SLIPID_POPG.def defFILE.def sh ../../../../../scripts/order_parameters_calculate.sh mv OrdPars.dat OrdParsPOPG.dat

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