On Tuesday 10 August 2010 10:30:17 am Sue Roberts wrote:
> Hello Everyone
>
> There's probably an easy way to do this, but I haven't found it.
>
> I've refined a 1.1 A structure with refmac and want to inspect the thermal
> ellipsoids. Specifically I want to know if any of them are non-positive
Hello Everyone
There's probably an easy way to do this, but I haven't found it.
I've refined a 1.1 A structure with refmac and want to inspect the thermal
ellipsoids. Specifically I want to know if any of them are non-positive
definite and I want to know which have very large anisotropy. (I ca
