Toward a global maximization of the molecular similarity function: Superposition of two molecules

Article

Abstract: A quantum similarity measure between two molecules is normally identified with the maximum value of

Palabras claves:

Atomic shell approximation (ASA), Global maximization, Molecular alignments, Molecular quantum similarity measures (MQSM)

Autores:

Amat L., Constans P., Ramón Carbö-D̈orca

Fuentes:

scopus