The Signature Molecular Descriptor. 4. Canonizing Molecules Using Extended Valence Sequences

American Chemical Society (ACS) - Tập 44 Số 2 - Trang 427-436 - 2004
Jean‐Loup Faulon1,2, Michael J. Collins1, Robert D. Carr1
1Departments of Computational Biology, Cryptography, and Discrete Algorithms and Mathematics, Sandia National Laboratories, P.O. Box 969, MS 9951, Livermore, California 94551, and Department of Computer Science MSC01 11301 1, University of New Mexico, Albuquerque, New Mexico 87131-0001
2School of Chemistry

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