VlachosGroup / AIMSim

A Python toolbox to work with molecular similarity
https://vlachosgroup.github.io/AIMSim/README.html
MIT License
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Compile a list of similarity and distance measures to implement #78

Closed himaghna closed 3 years ago

himaghna commented 3 years ago

Binary similarity metrics Similarity Coefficients for Binary Chemoinformatics Data: Overview and Extended Comparison Using Simulated and Real Data Sets Roberto Todeschini, Viviana Consonni†, Hua Xiang, John Holliday, Massimo Buscema, and Peter Willett

Multivariate similarity metrics Benchmarking of multivariate similarity measures for high-content screening fingerprints in phenotypic drug discovery Felix Reisen , Xian Zhang, Daniela Gabriel, Paul Selzer