src/programs/mdrun/tests/glycine_no_constraints_vacuo.top

   1 ; Include forcefield parameters
   2 #include "charmm27.ff/forcefield.itp"
   3
   4 #include "glycine_vacuo.itp"
   5
   6 [ system ]
   7 ; Name
   8 Glycine
   9
  10 [ molecules ]
  11 ; Compound        #mols
  12 Glycine           1