2008 |
18 | EE | Maciej Haranczyk,
John D. Holliday,
Peter Willett,
Maciej Gutowski:
Structure and singly occupied molecular orbital analysis of anionic tautomers of guanine.
Journal of Computational Chemistry 29(8): 1277-1291 (2008) |
2004 |
17 | EE | John D. Holliday,
Sarah L. Rodgers,
Peter Willett,
Min-You Chen,
Mahdi Mahfouf,
Kevin Lawson,
Graham Mullier:
Clustering Files of Chemical Structures Using the Fuzzy k-Means Clustering Method.
Journal of Chemical Information and Modeling 44(3): 894-902 (2004) |
2003 |
16 | EE | John D. Holliday,
Stephen P. Jelfs,
Peter Willett,
Peter Gedeck:
Calculation of Intersubstituent Similarity Using R-Group Descriptors.
Journal of Chemical Information and Computer Sciences 43(2): 406-411 (2003) |
15 | EE | Naomie Salim,
John D. Holliday,
Peter Willett:
Combination of Fingerprint-Based Similarity Coefficients Using Data Fusion.
Journal of Chemical Information and Computer Sciences 43(2): 435-442 (2003) |
14 | EE | John D. Holliday,
Naomie Salim,
Martin Whittle,
Peter Willett:
Analysis and Display of the Size Dependence of Chemical Similarity Coefficients.
Journal of Chemical Information and Computer Sciences 43(3): 819-828 (2003) |
1996 |
13 | EE | Michael F. Lynch,
John D. Holliday:
The Sheffield Generic Structures Project-a Retrospective Review.
Journal of Chemical Information and Computer Sciences 36(5): 930-936 (1996) |
1995 |
12 | | John D. Holliday,
Michael F. Lynch:
Computer Storage and Retrieval of Generic Chemical Structures in Patents, 16. The Refined Search: An Algorithm for Matching Components of Generic Chemical Structures at the Atom-Bond Level.
Journal of Chemical Information and Computer Sciences 35(1): 1-7 (1995) |
11 | | John D. Holliday,
Michael F. Lynch:
Computer Storage and Retrieval of Generic Chemical Structures in Patents, 17. Evaluation of the Refined Search.
Journal of Chemical Information and Computer Sciences 35(4): 659-662 (1995) |
1994 |
10 | EE | John D. Holliday,
Geoffrey M. Downs,
Valerie J. Gillet,
Michael F. Lynch,
Winfried Dethlefsen:
Evaluation of the screening stages of the Sheffield Research Project on Computer Storage and Retrieval of Generic Chemical Structures in Patents.
Journal of Chemical Information and Computer Sciences 34(1): 39-46 (1994) |
1993 |
9 | EE | John D. Holliday,
Geoffrey M. Downs,
Valerie J. Gillet,
Michael F. Lynch:
Computer storage and retrieval of generic chemical structures in patents. 15. Generation of topological fragment descriptors from nontopological representations of generic structure components.
Journal of Chemical Information and Computer Sciences 33(3): 369-377 (1993) |
1992 |
8 | EE | John D. Holliday,
Geoffrey M. Downs,
Valerie J. Gillet,
Michael F. Lynch:
Computer storage and retrieval of generic chemical structures in patents. 14. Fragment generation from generic structures.
Journal of Chemical Information and Computer Sciences 32(5): 453-462 (1992) |
1991 |
7 | EE | Winfried Dethlefsen,
Michael F. Lynch,
Valerie J. Gillet,
Geoffrey M. Downs,
John D. Holliday,
John M. Barnard:
Computer storage and retrieval of generic chemical structures in patents. 11. Theoretical aspects of the use of structure languages in a retrieval system.
Journal of Chemical Information and Computer Sciences 31(2): 233-253 (1991) |
6 | EE | Winfried Dethlefsen,
Michael F. Lynch,
Valerie J. Gillet,
Geoffrey M. Downs,
John D. Holliday,
John M. Barnard:
Computer storage and retrieval of generic chemical structures in patents. 12. Principles of search operations involving parameter lists: matching-relations, user-defined match levels, and transition from the reduced graph search to the refined search.
Journal of Chemical Information and Computer Sciences 31(2): 253-260 (1991) |
5 | EE | Valerie J. Gillet,
Geoffrey M. Downs,
John D. Holliday,
Michael F. Lynch,
Winfried Dethlefsen:
Computer storage and retrieval of generic chemical structures in patents. 13. Reduced graph generation.
Journal of Chemical Information and Computer Sciences 31(2): 260-270 (1991) |
1989 |
4 | EE | Geoffrey M. Downs,
Valerie J. Gillet,
John D. Holliday,
Michael F. Lynch:
Review of ring perception algorithms for chemical graphs.
Journal of Chemical Information and Computer Sciences 29(3): 172-187 (1989) |
3 | EE | Geoffrey M. Downs,
Valerie J. Gillet,
John D. Holliday,
Michael F. Lynch:
Theoretical aspects of ring perception and development of the extended set of smallest rings concept.
Journal of Chemical Information and Computer Sciences 29(3): 187-206 (1989) |
2 | EE | Geoffrey M. Downs,
Valerie J. Gillet,
John D. Holliday,
Michael F. Lynch:
Computer storage and retrieval of generic chemical structures in patents. 9. An algorithm to find the extended set of smallest rings in structurally explicit generics.
Journal of Chemical Information and Computer Sciences 29(3): 207-214 (1989) |
1 | EE | Geoffrey M. Downs,
Valerie J. Gillet,
John D. Holliday,
Michael F. Lynch:
Computer storage and retrieval of generic chemical structures in patents. 10. Assignment and logical bubble-up of ring screens for structurally explicit generics.
Journal of Chemical Information and Computer Sciences 29(3): 215-224 (1989) |