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exercises:2018_uzh_acpc2:l-j_flu

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exercises:2018_uzh_acpc2:l-j_flu [2018/04/26 08:34] – gtocciexercises:2018_uzh_acpc2:l-j_flu [2020/08/21 10:15] (current) – external edit 127.0.0.1
Line 78: Line 78:
       &END NONBONDED       &END NONBONDED
     &END FORCEFIELD     &END FORCEFIELD
 +    &POISSON              # Poisson solver
 +      &EWALD
 +        EWALD_TYPE none
 +      &END EWALD
 +    &END POISSON
   &END MM   &END MM
  
Line 83: Line 88:
        &CELL        &CELL
          ABC [angstrom] 40 40 40          ABC [angstrom] 40 40 40
 +         PERIODIC NONE
        &END CELL        &END CELL
       &COORD       &COORD
exercises/2018_uzh_acpc2/l-j_flu.1524731690.txt.gz · Last modified: (external edit)