On Wed, May 23, 2012, Jesper Sørensen wrote:
>
> In the code snippet here below the C1, C2, and C3 atomtypes,
> am I correct if I think these are either united-atoms (e.g. CH3) or
> belonging to NA (e.g. C1')?
The former, which is why you get such big radii for C1, C2, C3.
....dac
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Received on Wed May 23 2012 - 19:00:04 PDT
