Feature trees: A new molecular similarity measure based on tree matching

By Matthias Rarey, J. Scott Dixon. 1998

How researchers see this paper

The researchers whose trusted networks rank it highest, strongest advocate first. Every researcher gets a different order.

1. Wengong Jin
2. Gerhard Klebe
3. Shitong Luo
4. Jean-Louis Reymond
5. Ryan-Rhys Griffiths
6. Philippe Schwaller
7. Regina Barzilay
8. Christopher Morris

Citations in the corpus

• Junction Tree Variational Autoencoder for Molecular Graph Generation (2018, methodology): “Tree Decomposition of Molecules Here we present our tree decomposition algorithm tailored for molecules, which finds its root in chemistry (Rarey & Dixon, 1998).”
• Virtual ligand screening: strategies, perspectives and limitations (2006, methodology): “An alternative tool is FeatureTrees, which can retrieve molecules of similar topology in feature space [90].”