ayayankina / atom-mapping-ensemble Star 0 Code Issues Pull requests Воспроизведение AMNet и ансамблирование с LocalMapper для atom-to-atom mapping химических реакцийpythonmachine-learningdeep-learningcheminformaticspytorchrdkitgraph-neural-networksamnetgnnreaction-smilesatom-mappinglocalmapper Updated Jun 25, 2026Jupyter Notebook