From owner-chemistry@ccl.net Thu Nov 12 09:19:01 2009
From: "Stephen Bowlus chezbowlus###comcast.net" <owner-chemistry(_)server.ccl.net>
To: CCL
Subject: CCL: remove salts from compounds
Message-Id: <-40674-091112091022-12426-Tb3yxJhXmiDvgMcwwE9yPw(_)server.ccl.net>
X-Original-From: Stephen Bowlus <chezbowlus..comcast.net>
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Date: Thu, 12 Nov 2009 06:10:01 -0800
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Sent to CCL by: Stephen Bowlus [chezbowlus|-|comcast.net]

>> Hi,
>>
>> Is there any free tool that can be used for removing ions/salts  
>> from a large
>> library of compounds?
>>
>> Thanks
>> AD
>>

Look at MayaChemTools.org.  There is a switch in the filterSDfiles  
script for washing salts from SD files (largest fragment kept).

-sb