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@zhantongz
Created February 24, 2017 06:40
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Argon topology???
[ defaults ]
; nbfunc comb-rule gen-pairs fudgeLJ fudgeQQ
1 1 no 1.0 1.0
[ atomtypes ]
Ar 39.948 0.0 A 0.00622127 9.69576e-06
[ moleculetype ]
; molname nrexcl
Arg 2
[ atoms ]
; id at type res nr residu name at name cg nr charge
1 Ar 1 Arg Ar 1 0
[ system ]
; Name
Argon
[ molecules ]
; Compound #mols
Arg 3
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