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Re: [ccp4bb]: solvent i.d. for act program
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Hi,
I do not know if you got any replies. It seems that act only recognises
solvent molecules if they have occupation 0. I am lloking into correcting
this.
Charles Ballard
CCP4
On Wed, 11 Jul 2001, Donovan Michael wrote:
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> Dear All
> How do I get the program 'ACT' to identify my water molecules in my
> pdb, at present they are labelled
>
> ATOM 4536 O HOH W xxxxx yyyyy zzzzz 1.00 20.00
>
> I've looked at the source code HOH should do it, but it just don't
>
> Hope someone can help
>
> Mike.
>
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