From: Ed B. <mre...@ya...> - 2011-06-05 12:23:49
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>When do people use SSSR? Why is it important? Hmmm. Begs the question then - is anyone actually using the SSSR algorithm in cdk? Is it going to be removed any time soon? For me it is just an academic exercise - can it be made to be more efficient. Also the minimum cycle basis which is the non-chemist term for the sssr is used by non-chemical applications who may not be so concerned with the rings that are missed - I'm guessing that's the case. So perhaps by improving the algorithm non-chemist applications may benefit. Although this is a chemistry development site of course! |