[Zinc-fans] Ph filter
John J. Irwin
jji at cgl.ucsf.edu
Mon Aug 13 14:57:30 PDT 2007
Hi Lena
Sorry to be so slow getting back to you. You can download molecules for
the pre-made subsets (by vendor or by physicochemical properties) as a
single representation at pH 7.
hope this helps.
John
Lena Dolghih wrote:
> hi,
>
> thanx for such a prompt reply. I have one more question. Is there a way to
> select a subset of compounds just of reference pH?
>
> Lena
>
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