On Sat, Feb 09, 2013, Sanjib Paul wrote:
> For atom: .R<Cl- 4897>.A<Cl- 1> Could not find type: Cl-
I have to guess here, since you didn't give much information about what you
actually did.
If you are using a recent Amber ff (ff10 or ff12SB, for example), you must
explicitly load the ion parameters you want, which are the ones that are
matched to the water model you are using.
See section 2.11 of the AmberTools12 Reference Manual.
...dac
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Received on Sat Feb 09 2013 - 07:00:02 PST
