From mn1 |-at-| helix.nih.gov  Tue Dec  2 15:38:57 1997
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Date: Tue, 2 Dec 1997 15:30:36 -0500 (EST)
From: "M. Nicklaus" <mn1 \\at// helix.nih.gov>
Message-Id: <199712022030.PAA05821 -8 at 8- helix.nih.gov>
To: CHEMISTRY%!at!%www.ccl.net
Subject: Re: MDL MOL File Format
Cc: jschcoch[ AT ]nanode.com, mn1[ AT ]helix.nih.gov


On Tue, 2 Dec 1997, an-Pierre Schoch <jschoch;at;nanode.com> wrote:

> I want to produce a file in mdl mol  and sdf format from a fortran
> program. Does anybody know where
> I can find the file specifications.

Dalby et al., J. Chem. Inf. Comput. Sci. 32(3), 244-255 (1992)

Marc

------------------------------------------------------------------------
 Marc C. Nicklaus                        National Institutes of Health
 E-mail: mn1 -8 at 8- helix.nih.gov               Bldg 37, Rm 5B29
 Phone:  (301) 402-3111                  BETHESDA, MD 20892-4255    USA
 Fax:    (301) 496-5839    
      http://rex.nci.nih.gov/RESEARCH/basic/medchem/mcnbio.htm
    Laboratory of Medicinal Chemistry, National Cancer Institute,  &
  Lab. of Structural Biology, Div. of Computer Research and Technology
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