CCL: Looking for a structure to name conversion software



I am presently involved in writing a book chapter regarding Name to Structure conversion. Dennis, would you please contact me offline to discuss the objective criteria you used to compare the three products. Thanks

 

Antony Williams,
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From: owner-chemistry!^!ccl.net [mailto:owner-chemistry!^!ccl.net]
Sent: Wednesday, December 05, 2007 9:41 AM
To: Antony Williams
Subject: CCL: Looking for a structure to name conversion software

 

The options for converting names to structures are three companies/products:

 

  1. ACD has a batch program.
  2. Cambridgesoft has a batch program.
  3. OpenEyes has a product LexiChem. 

 

I evaluated all three in 2006 and preferred Lexichem. 

 

I am unaware of any free software. 

 

-- Dennis

 

Dennis G. Sprous, PhD

Chemoinformatics/Computational Chemistry

RedPointBio Inc.

7 Graphics Drive Ewing NJ 08628

609-637-9700


From: owner-chemistry.:.ccl.net [mailto:owner-chemistry.:.ccl.net]
Sent: Wednesday, December 05, 2007 8:02 AM
To: Dennis Sprous
Subject: CCL: Looking for a structure to name conversion software

 

ChemOffice may do that better, but it is commerical software.

On Nov 16, 2007 6:39 PM, drmsaravanan=aim.com <owner-chemistry(~)ccl.net > wrote:


Hi All,

Is there any tool  to convert 1000 structures to name at a stretch? it would be better if it is available freely.

regards,

M. Saravanan


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