Unique Ring Families: A Chemically Meaningful Description of Molecular Ring Topologies
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[1] W. Todd Wipke,et al. Use of Ring Assemblies in Ring Perception Algorithm , 1975, J. Chem. Inf. Comput. Sci..
[2] Shinsaku Fujita,et al. A new algorithm for selection of synthetically important rings. The essential set of essential rings for organic structures , 1988, J. Chem. Inf. Comput. Sci..
[3] E. J. Corey,et al. Algorithm for machine perception of synthetically significant rings in complex cyclic organic structures , 1972 .
[4] Morris Plotkin,et al. Mathematical Basis of Ring-Finding Algorithms in CIDS , 1971 .
[5] Yanli Wang,et al. PubChem: a public information system for analyzing bioactivities of small molecules , 2009, Nucleic Acids Res..
[6] Antonio Zamora,et al. An Algorithm for Finding the Smallest Set of Smallest Rings , 1976, J. Chem. Inf. Comput. Sci..
[7] David G. Lloyd,et al. Permuting input for more effective sampling of 3D conformer space , 2006, J. Comput. Aided Mol. Des..
[8] Franziska Berger,et al. Counterexamples in Chemical Ring Perception , 2004, J. Chem. Inf. Model..
[9] Philippe Vismara,et al. Union of all the Minimum Cycle Bases of a Graph , 1997, Electron. J. Comb..
[10] Thierry Hanser,et al. A New Algorithm for Exhaustive Ring Perception in a Molecular Graph , 1996, J. Chem. Inf. Comput. Sci..
[11] Peter F. Stadler,et al. Interchangeability of Relevant Cycles in Graphs , 2000, Electron. J. Comb..
[12] Raphael Yuster,et al. Packing Graphs: The packing problem solved , 1996, Electron. J. Comb..
[13] José A. Dobado Jimez,et al. CoNTub v2.0 - Algorithms for Constructing C3-Symmetric Models of Three-Nanotube Junctions , 2011, J. Chem. Inf. Model..
[14] Renzo Balducci,et al. Efficient exact solution of the ring perception problem , 1994, J. Chem. Inf. Comput. Sci..
[15] Matthias Rarey,et al. NAOMI: On the Almost Trivial Task of Reading Molecules from Different File formats , 2011, J. Chem. Inf. Model..
[16] Michael F. Lynch,et al. Theoretical Aspects of Ring Perception and Development of the Extended Set of Smallest Rings Concept. , 1989 .
[17] Thibaud Latour,et al. A New Graph Descriptor for Molecules Containing Cycles. Application as Screening Criterion for Searching Molecular Structures within Large Databases of Organic Compounds , 2001, J. Chem. Inf. Comput. Sci..
[18] Robert E. Tarjan,et al. An Efficient Parallel Biconnectivity Algorithm , 2011, SIAM J. Comput..