adjust input according to new syntax
This commit is contained in:
@ -54,25 +54,25 @@ fix 1 all nve
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thermo 1
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run 0
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read_dump dump.xyz 1 x y z format xyz box no
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read_dump dump.xyz 1 x y z box no format xyz
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run 0 pre yes post no
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read_dump dump.melt 50 x y z format native box yes
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read_dump dump.melt 50 x y z box yes format native
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run 0 pre yes post no
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rerun dump.xyz dump x y z format xyz box no
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rerun dump.melt dump x y z format native box yes
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read_dump dump.xyz 1 x y z format molfile box no reader xyz "."
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rerun dump.xyz dump x y z box no format xyz
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rerun dump.melt dump x y z box yes format native
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read_dump dump.xyz 1 x y z box no format molfile xyz "."
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run 0 pre yes post no
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read_dump dump.melt 1 x y z format molfile box yes reader lammpstrj
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read_dump dump.melt 1 x y z box yes format molfile lammpstrj
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run 0 pre yes post no
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rerun dump.xyz dump x y z format molfile box no reader xyz
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rerun dump.dcd dump x y z format molfile box no reader dcd
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rerun dump.xyz dump x y z box no format molfile xyz
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rerun dump.dcd dump x y z box no format molfile dcd
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read_dump dump-ele.xyz 1 x y z format xyz box no
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read_dump dump-ele.xyz 1 x y z box no format xyz
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run 0 pre yes post no
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rerun dump-ele.xyz dump x y z format molfile box no reader xyz
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rerun dump.dcd dump x y z format molfile box yes reader dcd
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rerun dump-ele.xyz dump x y z box no format molfile xyz
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rerun dump.dcd dump x y z box yes format molfile dcd
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rerun dump.vels dump x y z vx vy vz format native box yes
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rerun dump.vels dump x y z vx vy vz box yes format native
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rerun dump.vels dump x y z vx vy vz format molfile box yes reader lammpstrj
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rerun dump.vels dump x y z vx vy vz box yes format molfile lammpstrj
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