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ideaconsult / cdk

The Chemistry Development Kit
https://cdk.github.io/
GNU Lesser General Public License v2.1
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fixed typo in method getIinchis; completed javadocs; added method to … #11

Closed uli-f closed 1 year ago

uli-f commented 1 year ago

…return map with (inchi, auxinfo) pairs; added final modifier to rinchiDecompositionOutput; change return types of public methods from array to java.util.collection objects

uli-f commented 1 year ago

I am happy with arrays as return types in jna-rinchi as this feels more like lower-level code.

But within the CDK I'd prefer data structures from java.util.collection such as List, Map etc so I changed the return types of public methods in RinchiDecomposition.