On Wed, Oct 08, 2014, Jonathan Gough wrote:
>
> Is there a way to maintain the original coordinates from your PDB file
> after you have imported your protein into leap and soaked it in a solvent
> box?
Try the "set default nocenter on" command in LEaP. I'm not sure what this
does in the context of the solvateBox/solvateOct commands, but it's worth a
try.
....dac
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Received on Wed Oct 08 2014 - 16:30:02 PDT
