2007 |
27 | EE | Douglas J. Klein,
Tomislav Doslic,
Danail Bonchev:
Vertex-weightings for distance moments and thorny graphs.
Discrete Applied Mathematics 155(17): 2294-2302 (2007) |
2006 |
26 | EE | Douglas J. Klein,
Alexandru T. Balaban:
The Eight Classes of Positive-Curvature Graphitic Nanocones.
Journal of Chemical Information and Modeling 46(1): 307-320 (2006) |
25 | EE | Alexandru T. Balaban,
Douglas J. Klein:
Is chemistry 'TheCentral Science'? How are different sciences related? Co-citations, reductionism, emergence, and posets.
Scientometrics 69(3): 615-637 (2006) |
2005 |
24 | EE | Teodora Ivanciuc,
Ovidiu Ivanciuc,
Douglas J. Klein:
Posetic Quantitative Superstructure/Activity Relationships (QSSARs) for Chlorobenzenes.
Journal of Chemical Information and Modeling 45(4): 870-879 (2005) |
2004 |
23 | EE | Teodora Ivanciuc,
Douglas J. Klein:
Parameter-Free Structure-Property Correlation via Progressive Reaction Posets for Substituted Benzenes.
Journal of Chemical Information and Modeling 44(2): 610-617 (2004) |
22 | EE | Douglas J. Klein,
José Luis Palacios,
Milan Randic,
Nenad Trinajstic:
Random Walks and Chemical Graph Theory.
Journal of Chemical Information and Modeling 44(5): 1521-1525 (2004) |
21 | EE | Tetsuo Morikawa,
Susumu Narita,
Douglas J. Klein:
Molecules-in-Molecule Estimation of the Extent of Localization of Kekuléan Substructures in Polycyclic Aromatic Hydrocarbons.
Journal of Chemical Information and Modeling 44(6): 1891-1896 (2004) |
2002 |
20 | EE | Ovidiu Ivanciuc,
Douglas J. Klein:
Computing Wiener-Type Indices for Virtual Combinatorial Libraries Generated from Heteroatom-Containing Building Blocks.
Journal of Chemical Information and Computer Sciences 42(1): 8-22 (2002) |
19 | EE | Douglas J. Klein:
Topological Indices and Related Descriptors in QSAR and QSPR Edited by James Devillers & Alexandru T. Balaban. Gordon and Breach Science Publishers: Singapore, 1999, 811 pp, ISBN 90-5699-239-2.
Journal of Chemical Information and Computer Sciences 42(6): 1507-1507 (2002) |
2001 |
18 | EE | Ovidiu Ivanciuc,
Teodora Ivanciuc,
Douglas J. Klein,
William A. Seitz,
Alexandru T. Balaban:
Wiener Index Extension by Counting Even/Odd Graph Distances.
Journal of Chemical Information and Computer Sciences 41(3): 536-549 (2001) |
2000 |
17 | EE | Laimutis Bytautas,
Douglas J. Klein:
Mean Wiener Numbers and Other Mean Extensions for Alkane Trees.
Journal of Chemical Information and Computer Sciences 40(2): 471-481 (2000) |
1999 |
16 | EE | Douglas J. Klein,
Ivan Gutman:
Wiener-Number-Related Sequences.
Journal of Chemical Information and Computer Sciences 39(3): 534-536 (1999) |
15 | EE | Laimutis Bytautas,
Douglas J. Klein:
Alkane Isomer Combinatorics: Stereostructure Enumeration and Graph-Invariant and Molecular-Property Distributions.
Journal of Chemical Information and Computer Sciences 39(5): 803-818 (1999) |
1998 |
14 | EE | Laimutis Bytautas,
Douglas J. Klein:
Chemical Combinatorics for Alkane-Isomer Enumeration and More.
Journal of Chemical Information and Computer Sciences 38(6): 1063-1078 (1998) |
1997 |
13 | EE | Alexandru T. Balaban,
Xiaoyu Liu,
Douglas J. Klein,
Darko Babic,
Thomas G. Schmalz,
William A. Seitz,
Milan Randic:
Graphic Invariants for Fullerenes [J. Chem. Inf. Comput. Sci 35, 396-404 (1995)].
Journal of Chemical Information and Computer Sciences 37(3): 630 (1997) |
1996 |
12 | EE | Douglas J. Klein,
H.-Y. Zhu:
Resonance in Elemental Benzenoids.
Discrete Applied Mathematics 67(1-3): 157-173 (1996) |
11 | EE | H.-Y. Zhu,
Douglas J. Klein,
István Lukovits:
Extensions of the Wiener Number.
Journal of Chemical Information and Computer Sciences 36(3): 420-428 (1996) |
10 | EE | H.-Y. Zhu,
Douglas J. Klein:
Graph-Geometric Invariants for Molecular Structures.
Journal of Chemical Information and Computer Sciences 36(6): 1067-1075 (1996) |
1995 |
9 | | Douglas J. Klein,
István Lukovits,
Ivan Gutman:
On the Definition of the Hyper-Wiener Index for Cycle-Containing Structures.
Journal of Chemical Information and Computer Sciences 35(1): 50-52 (1995) |
8 | | Alexandru T. Balaban,
Xiaoyu Liu,
Douglas J. Klein,
Darko Babic,
Thomas G. Schmalz,
William A. Seitz,
Milan Randic:
Graph Invariants for Fullerenes.
Journal of Chemical Information and Computer Sciences 35(3): 396-404 (1995) |
7 | | Darko Babic,
Alexandru T. Balaban,
Douglas J. Klein:
Nomenclature and Coding of Fullerenes.
Journal of Chemical Information and Computer Sciences 35(3): 515-526 (1995) |
6 | | Tomislav P. Zivkovic,
Milan Randic,
Douglas J. Klein,
Hongyao Zhu,
Nenad Trinajstic:
Analytical Approach to Very Large Benzenoid Polymers.
Journal of Computational Chemistry 16(4): 517-526 (1995) |
1994 |
5 | EE | Douglas J. Klein:
Elemental Benzenoids.
Journal of Chemical Information and Computer Sciences 34(2): 453-459 (1994) |
1993 |
4 | EE | Alexandru T. Balaban,
Xiaoyu Liu,
Sven J. Cyvin,
Douglas J. Klein:
Benzenoids with maximum Kekule structure counts for given numbers of hexagons.
Journal of Chemical Information and Computer Sciences 33(3): 429-436 (1993) |
1992 |
3 | EE | Thomas G. Schmalz,
Douglas J. Klein,
B. L. Sandleback:
Chemical graph-theoretical cluster expansion and diamagnetic susceptibility.
Journal of Chemical Information and Computer Sciences 32(1): 54-57 (1992) |
2 | EE | Douglas J. Klein,
Zlatko Mihalic,
Dejan Plavsic,
Nenad Trinajstic:
Molecular topological index: a relation with the Wiener index.
Journal of Chemical Information and Computer Sciences 32(4): 304-305 (1992) |
1990 |
1 | EE | Sonja Nikolic,
Nenad Trinajstic,
Douglas J. Klein:
The conjugated-circuit model.
Computers & Chemistry 14(4): 313-322 (1990) |