Dear Crystallographers,
does anyone know of a program to compare multiple structures and
identify which solvent molecules (water, ions, etc.) are conserved
between the structures? I guess it would be nice also if it could
identify when, for example, a Cl- in structure A was re-occupied by an
HOH i
Hi Jacob,
On Wed, 2011-05-25 11:58 EDT, Jacob Keller
wrote:
> Dear Crystallographers,
>
> does anyone know of a program to compare multiple structures and
> identify which solvent molecules (water, ions, etc.) are conserved
> between the structures? I guess it would be nice also if it could
>
Thanks Robert, this really did the trick!
All the best,
Jacob Keller
On Wed, May 25, 2011 at 12:38 PM, Robert Campbell
wrote:
> Hi Jacob,
>
> On Wed, 2011-05-25 11:58 EDT, Jacob Keller
> wrote:
>
>> Dear Crystallographers,
>>
>> does anyone know of a program to compare multiple structures an