On 11/11/2012 04:01, Sarah Rodriguez wrote:
> Hello,
> I am wondering if I have 2 large databases that I want to compare the
> structures in, would I be able to do this in babel?
It depends what you mean by databases and compare.
OpenBabel can find duplicate molecules (i.e. with the same structur
Hello,
I am wondering if I have 2 large databases that I want to compare the
structures in, would I be able to do this in babel?
Thanks,
Sarah
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