InnocentBug / G-BigSMILES

Generator of SMILES string from bigSMILES with extension
GNU General Public License v3.0
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Stochastic atom graph, new feature #50

Closed InnocentBug closed 8 months ago

InnocentBug commented 8 months ago

Convert G-BigSMILES into a graph representation that shows every atom, and the connection between atoms can either be static (always present), stochastic (for repetition in stochastic elements), termination (for ending stochastic elements), or transition for between stochastic elements and regular smiles tokens.

This also comes with an implementation that can convert these graphs directly into normal atom graphs.

trunk-io[bot] commented 8 months ago

😎 Merged successfully (details).

InnocentBug commented 8 months ago

/trunk merge