[Zinc-fans] missing NCI compounds in zinc?

John Irwin jji at cgl.ucsf.edu
Wed Aug 24 09:47:29 PDT 2005


Unfortunately, I've been giving out dates since April. I now think it will
appear in September.
 

> -----Original Message-----
> From: J. Tasman [mailto:tasman at u.washington.edu] 
> Sent: Wednesday, August 24, 2005 9:46 AM
> To: John Irwin
> Cc: zinc-fans at docking.org
> Subject: RE: [Zinc-fans] missing NCI compounds in zinc?
> 
> 
> Any chance of a ballpark estimate of when the next update 
> will be made public?
> 
> Thanks,
> 
> Josh
> 
> 
> ...
> > The current version of ZINC has (incorrectly) MMFF94S charges on
> atoms. 
> ...
> > The version now in preparation has (correctly) AMSOL 
> charges as we use 
> > in our work and publish in our papers.
> 
> 



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