Subject: Re: CCL:file convertion

From: "Tamas E. Gunda" <[email-masked]>
Date: Tue, 2 Jan 2001 08:56:24 +0100

Mol2Mol can do this type of conversion, i.e. multiple pdb files to multiple Sybyl mol2 or MDL sdf files.
see: www.compuchem.com/mol2mol.htm 

Dr Tamas E. Gunda
Research Group for Antibiotics of the Hungarian Acad. Sci.
University of Debrecen, POBox 36
H-4010 Debrecen, Hungary
tel.: (+36-52) 512 900/2472
fax: (+36-52) 512 914
e-mail: [email-masked]
home-page: www.klte.hu/~gundat/gunda.htm

----- Original Message ----- 
> Hi!
>     I would greatly appreciate if someone can give me suggestions on how
> to convert a pdb file [containing multiple small molecules that was
> obtained from DOCK (UCSF) run] to a mult-mol2 or multi-sdf file. I would
> also like to keep the mol-ID of each compound in those files.
>     Thank you in advance for your help and Happy New Year to all of you!
> 
> Asim
> 
> --
> 
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>            ****                 Lindsley F. Kimball Research Institute
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