Bertrand-Caron/Fragment_Capping: Beta Release: Fragment Capping

Software OPEN SOURCE
Bertrand Caron; Martin Engler;
(2018)

<p>Beta release of the fragment capping project. The tautomer enumeration is now working, and switches for the most common problems (non-physical tautomers) have been provided: allenes and triple bonds in small rings (size &lt;=7), hydrogenation of phenyl rings. Many te... View more
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