References
- Todeschini , R. and Consonni , V. May 30 to June 3 2000 . “ poster presentation ” . In The Handbook of Molecular Descriptors , May 30 to June 3 , Duluth, , USA : University of Minnesota . presented) at the Second Indo-US Workshop on Mathematical Chemistry held from
- Randić , M. and Basak , S. C. 1991 . Optimal molecular descriptors based on weighted path numbers . J. Chem. Inf. Comput. Sci. , 39 : 261 – 266 .
- Randić , M. and Basak , S. C. 2000 . Multiple regression analysis with optimal molecular descriptors . SAR QSAR Environ. Res. , 11 : 1 – 23 .
- Balaban , A. T. 1976 . Chemical Applications of Graph Theory , 389 London : Academic Press .
- Balaban , A. T. 1982 . Highly discriminating distance-based topological index . Chem. Phys. Lett. , 80 : 399 – 404 .
- Balaban , A. T. 1983 . Topological indices based on topological distances in molecular graphs . Pure Appl. Chem. , 55 : 199 – 206 .
- Balaban , A. T. 1992 . Using real numbers as vertex invariants for third-generation topological indices . J. Chem. Inf. Comput. Sci. , 32 : 23 – 28 .
- Balaban , A. T. 1993 . Lowering the intra- and intermolecular degeneracy of topological invariants . Croat. Chem. Acta , 66 : 447 – 458 .
- Balaban , A. T. 1997 . From Chemical Topology to Three-Dimensional Geometry , 420 New York : Plenum Press .
- Devillers , J. and Balaban , A. T. 1999 . Topological Indices and Related Descriptors in QSAR and QSPR , 811 Amsterdam : Gordon and Breach .
- Balaban , A. T. , Mills , D. , Ivanciuc , O. and Basak , S. C. 2000 . Reverse Wiener indices . Croat. Chem. Acta , 73 : 923 – 941 .
- Mihalić , Z. , Nikolić , Z. and Trinajstić , N. 1992 . Comparative study of molecular descriptors derived from the distance matrix . J. Chem. Inf. Comput. Sci. , 32 : 28 – 37 .
- Rücker , G. and Rücker , C. 1998 . Symmetry-aided computation of the detour matrix and the detour index . J. Chem. Inf. Comput. Sci. , 38 : 710 – 714 .
- Lučić , B. , Lukovits , I. , Nikolić , S. and Trinajstić , N. 2000 . On the distance indices in QSPR modeling. . J. Chem. Inf. Comput. Sci. , in press.
- Wiener , H. 1947 . Structural determination of paraffin boiling points . J. Am. Chem. Soc. , 69 : 17 – 20 .
- Plavšić , D. , Nikolić , S. , Trinajstić , N. and Mihalić , Z. 1993 . On the Harary index for characterization of chemical graphs . J. Math. Chem. , 12 : 235 – 250 .
- Ivanciuc , O. , Balaban , T.-S. and Balaban , A. T. 1993 . Design of topological indices. Part 4. Reciprocal distance matrix, related local vertex invariants and topological indices . J. Math. Chem. , 12 : 309 – 312 .
- Ivanciuc , O. and Balaban , A. T. 1994 . Design of topological indices. Part 8. Path matrices and derived molecular graph invariants . Comm. Math. Chem. (MATCH) , 30 : 141 – 152 .
- Amić , D. and Trinajstić , N. 1995 . On the detour matrix . Croat. Chem. Acta , 68 : 53 – 62 .
- Randić , M. 1993 . Novel molecular descriptor for structure-property studies . Chem. Phys. Lett. , 211 : 478 – 483 .
- Randić , M. , Guo , X. , Oxley , T. , Krishnapyhriyan , H. and Naylor , L. 1994 . Wiener matrix invariants . J. Chem. Inf. Comput. Sci. , 34 : 361 – 367 .
- Lukovits , I. and Linert , W. 1994 . A novel definition of the hyper-Wiener index for cycles . J. Chem. Inf. Comput. Sci. , 34 : 899 – 902 .
- Diudea , M. 1997 . Indices of reciprocal properties or Harary indices . J. Chem. Inf. Comput. Sci. , 37 : 292 – 299 .
- Lukovits , I. 1996 . The detour index . Croat. Chem. Acta , 69 : 873 – 882 .
- Harary , F. 1971 . Graph Theory , 203 Reading, MA : Addison-Wesley . 2nd printing.
- Trinajstić , N. 1992 . Chemical Graph Theory , 322 Boca Raton. FL : 2nd edition. CRC Press .
- Hosoya , H. 1971 . Topological index. A newly proposed quantity characterizing topological nature of structural isomers of saturated hydrocarbons . Bull. Chem. Soc. Jpn. , 44 : 2332 – 2339 .
- Mihalić , Z. , Veljan , D. , Amić , D. , Nikolić , S. , Plavšič , D. and Trinajstić. , N. 1992 . The distance matrix in chemistry . J. Math. Chem. , 11 : 223 – 258 .
- Nikolić , S. , Trinajstić , N. and Mihalić , Z. 1995 . The Wiener index: Development and applications . Croat. Chem. Acta , 68 : 105 – 129 .
- Gutman , I. , Klavźar , S. and Mohar , B. , eds. 1997 . “ Fifty years of the Wiener index ” . In Comm. Math. Comp. Chem. (MATCH) Vol. 35 , 1 – 259 .
- Bersohn , M. 1982 . A fast algorithm for calculation of the distance matrix of a molecule . J. Comput. Chem. , 4 : 110 – 113 .
- Müller , W. R. , Szymanski , K. , Knop , J. V. and Trinajstić , N. 1987 . An algorithm for construction of the molecular distance matrix . J. Comput. Chem. , 8 : 170 – 173 .
- Nikolić , S. and Trinajstić , N. On higher Wiener, Harary and detour indices. Work in progress.
- Trinajstić , N. , Nikolić , S. , Lučrić , B. , Amić , D. and Mihalić , Z. 1997 . The detour matrix in chemistry . J. Chem. Inf. Comput. Sci. , 37 : 631 – 638 .
- Nikolić , S. , Trinajstić , N. and Mihalić , Z. 1999 . “ Topological Indices and Related Descriptors in QSAR and QSPR ” . In The detour matrix and the detour index. , Edited by: Devillers. , J. and Balaban , A. T. 279 – 306 . Amsterdam : Gordon and Breach .
- Trinajstić , N. , Nikolić , S. and Mihalić , Z. 1997 . On computing the molecular detour matrix . Int. J. Quantum Chem. , 65 : 415 – 419 .
- Lukovits , I. and Razinger , M. 1997 . On calculation of the detour matrix . J. Chem. Inf. Comput. Sci. , 27 : 283 – 286 .
- Rücker , G. and Rücker , C. 1999 . On topological indices, boiling points, and cycloalkanes . J. Chem. Inf. Comput. Sci. , 39 : 788 – 802 .
- Plavšić , D. , Lerš , N. and Sertić-Bionda , K. 2000 . On the relation between W'/W index, hyper-Wiener index and Wiener number . J. Chem. Inf. Comput. Sci. , 40 : 516 – 519 .
- Bonchev , D. and Trinajstić , N. 1977 . Information theory, distance matrix and molecular branching . J. Chem. Phys. , 67 : 4517 – 4533 .
- Ren , B. 1999 . A new topological index for QSR of alkanes . J. Chem. Inf. Comput. Sci. , 39 : 139 – 143 .
- Randić , M. 1975 . On characterization of molecular branching . J. Am. Chem. Soc. , 97 : 6609 – 6615 .
- Schultz , H. P. 1989 . Topological organic chemistry. 1. Graph theory and topological indices . J. Chem. Inf. Comput. Sci. , 29 : 227 – 228 .
- Amić , D. , Bešlo , D. , Lučić , B. , Nikolić , S. and Trinajstić , N. 1998 . The vertex-connectivity index revisited . J. Chem. Inf. Comput. Sci. , 38 : 819 – 822 .
- Basak , S. C. , Nikolić , S. , Trinajstić , N. , Amić , D. and Bešlo , D. 2000 . QSPR modeling: Graph connectivity indices versus line graph connectivity indices . J. Chem. Inf. Comput. Sci. , 40 in press.
- Rücker , G. and Rücker , C. 1993 . Counts of all walks as atomic and molecular descriptors . J. Chem. Inf. Comput. Sci. , 33 : 683 – 695 .