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More nodes for the Umbrella Sampling Gromacs Tutorial
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5/25/2018 Umbrella Sampling Extension
1/2
58 0.5000501
grompp -f npt_umbrella.mdp -c conf58.gro -p topol.top -n
index.ndx -o npt23.tpr
144 0.6960708
grompp -f npt_umbrella.mdp -c conf144.gro -p topol.top -nindex.ndx -o npt24.tpr
%164 0.9035559
175 1.1119405
grompp -f npt_umbrella.mdp -c conf175.gro -p topol.top -n
index.ndx -o npt25.tpr
182 1.2990141
grompp -f npt_umbrella.mdp -c conf182.gro -p topol.top -n
index.ndx -o npt26.tpr
186 1.5230001
grompp -f npt_umbrella.mdp -c conf186.gro -p topol.top -n
index.ndx -o npt27.tpr
195 1.9011049
grompp -f npt_umbrella.mdp -c conf195.gro -p topol.top -n
index.ndx -o npt28.tpr
242 2.7120137
grompp -f npt_umbrella.mdp -c conf242.gro -p topol.top -nindex.ndx -o npt29.tp
5/25/2018 Umbrella Sampling Extension
2/2