Pathway search

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Introduce source and target compound inchikey (can be retrieved from PubChem):

Network parameters

Modify distances within the network:

Truncate the network to exclude connections with low atom conservation:

Pathway search parameters

Importance of:

Maximum number of pathways in the output: {{ numIntSeqs * numRxnAlt * numEnzAlt }}

Compound filtering



Atom types


Metalloids and other non-metals

Ring types