On 06/13/2011 04:55 PM, DUFF, Anthony wrote:
> It may require some tricks, such as the creation of walls of CA atoms,
> but Kleywegt's FLOOD will give an answer in terms of number of water
> molecules.
Some more tools are referenced here:
http://hollow.sourceforge.net/
However, I did not tried them.
I don't know how they delimit the limits of channels,
which may be an interesting question.
Regards,
F.
> Anthony Duff
>
>
>
> -----Original Message-----
> From: CCP4 bulletin board on behalf of Matthew BOWLER
> Sent: Mon 6/13/2011 5:40 PM
> To: [log in to unmask]
> Subject: [ccp4bb] Solvent channel volume measurement
>
> Dear All,
> does anyone know of a program that can measure the volume or
> largest dimension of the solvent channels in crystals? Cheers, Matt.
>
> --
> Matthew Bowler
> Structural Biology Group
> European Synchrotron Radiation Facility
> B.P. 220, 6 rue Jules Horowitz
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