Extended similarity indices: the benefits of comparing more than two objects simultaneously. Part 2: speed, consistency, diversity selection - Miranda-Quintana, Ramón Alain; Rácz, Anita; Bajusz, Dávid; Héberger, Károly (Journal of cheminformatics, 2021)
Keywords: Algorithms; Chemical fingerprinting; Chemistry; Chemistry and Materials Science; Computational Biology/Bioinformatics; Computational complexity; Computer Applications in Chemistry; Consistency; Datasets; Documentation and Information in Chemistry; Embedding; Extended similarity indices; Informatics; Mathematical analysis; Matrix methods; Multiple comparisons; Rankings; Research Article; Scaling; Similarity; Theoretical and Computational Chemistry; Variance analysis; Multiple comparisons; Molecular fingerprints; Consistency; Scaling; Rankings; Extended similarity indices; Sum of ranking differences; Computational complexity