[Dock-fans] Inputing docking results into Sybyl
terry at cgl.ucsf.edu
Thu Oct 6 20:26:24 PDT 2005
I am not familiar with the Sybyl spreadsheet function. The
multi-mol2 file can be read into Sybyl, but I am not sure whether Sybyl
will recognize the Energy Score as a value. For MS Excel, as a first
approximation, you can grep the values out and open them as .txt files.
Any more advanced processing would have to be done with scripting.
Mikell Paige wrote:
> Is there a simple way to input database docking results into a Sybyl
> spreadsheet. I used Chimera and saw the results in the scored_out.mol2
> file, but would like to have the results in a Sybyl spreadsheet or
> even in MS Excel for further manipulation. Thanks.
> Dock-fans mailing list
> Dock-fans at docking.org
P. Therese Lang
Kuntz and James Labs
UCSF--Chemistry and Chemical Biology
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