[gmx-users] Invalid order for directive atomtypes

Albert mailmd2011 at gmail.com
Sat Jul 5 16:03:30 CEST 2014

HI Mark:

thanks a lot for comments.

I just played  around   and I noticed that I noticed that there is some 
invisible character inside the ligand.itp. After remove them by command 
dos2unix, and it works now.


On 07/05/2014 08:54 AM, Mark Abraham wrote:
> A different problem can happen; the same problem can't. But we don't know
> what the messages were, or the link you followed, so we're stuck. Perhaps
> you can learn about directive order in 5.7.1 of the manual - you cannot
> ever have [atomtypes] after [molecules], even if they're in .itp files.
> Mark

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