ADL: non-integral charges

Kit Fuhrman fuhrman at mail.ucf.edu
Sun Jan 15 10:29:17 PST 2006


I was wondering the same thing.  Does anyone have an answer?

How would someone go about fixing something like this?  Would you have to
manually edit the PDB file?

Kit Fuhrman




On 1/12/06 10:01 AM, "Carsten Baldauf"
<carsten.baldauf at biotec.tu-dresden.de> wrote:

> dear all//
> 
> i get error messages warning because of non-integral charges on my
> ligand ... how important are these?
> 
> thanks//
> carsten





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