@article{Simm2017, author = "Gregor N. Simm and Markus Reiher", title = "{Context-Driven Exploration of Complex Chemical Reaction Networks}", year = "2017", month = "11", url = "https://acs.figshare.com/articles/dataset/Context-Driven_Exploration_of_Complex_Chemical_Reaction_Networks/5583853", doi = "10.1021/acs.jctc.7b00945.s002" }