deuar GMXers,
my system doesn't work when i do energy minim. with cg after doing it using steep. The following message are showing:
"processing coordinates...
double-checking input for internal consistency...
ERROR: can not do Conjugate Gradients with constraints (201522)"
 I set in my .mdp not use constraints (constrainsts= none) and my water model is SPC216.
Can anyone help me?
Regards,
Samuel Pita.

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