AlkylStructureFragmenter Implementation#10
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Mila1004 wants to merge 231 commits intoproductionfrom
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…rst algorithm setting
…rst algorithm setting
…MORTAR into dev-Max-alkylfragmentation
… duplicate rings;
Collaborator
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@Mila1004 please simply revert your changes to Message_en_GB.properties to avoid merge conflicts. We will add you to the developers list later, no worries. |
Collaborator
When you are done with this and there are no more conflicts, you can merge production into your branch again to switch to the new build setup. |
…ven molecule name;
…bstructure of ring-connected tertiary or quaternary atoms;
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First steps for a complete alkyl structure fragmentation.
Currently only contains fragmentation logic for cyclic structures and non-cyclic side-chains.