On Mon, Nov 04, 2013, Jason Swails wrote:
>
> I added code to tleap to try and determine if C1, C2, and C3 atom types
> were in fact UA carbons by looking at their respective masses. Any
> C1/C2/C3 atom type with a 'normal' carbon mass is now assigned a radius
> of 1.7 A instead of 2.2.
>
> This is a temporary solution that should work fine until a more
> permanent solution is decided upon and implemented. [1]
I think this could wait -- it only affects those who are using ildn + GB; plus
we want to make sure there are not any other hidden problems of this general
type.
...dac
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Received on Mon Nov 04 2013 - 13:00:02 PST
