26 citations · 71 across the 21 of their papers we have counts for
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cs.FL2016
A Software Package for Chemically Inspired Graph Transformation
Jakob L. Andersen, Christoph Flamm, Daniel Merkle +1
Chemical reaction networks can be automatically generated from graph grammar descriptions, where rewrite rules model reaction patterns. Because a molecule graph is connected and re…
cs.FL2013★ 1 cited
Generic Strategies for Chemical Space Exploration
Jakob L. Andersen, Christoph Flamm, Daniel Merkle +1
Computational approaches to exploring "chemical universes", i.e., very large sets, potentially infinite sets of compounds that can be constructed by a prescribed collection of reac…