| 2005 |
|---|
| 8 | EE | John W. Raymond,
Christopher E. Kibbey:
An Automated Method for Exploring Targeted Substructural Diversity within Sets of Chemical Structures.
Journal of Chemical Information and Modeling 45(5): 1195-1204 (2005) |
| 2004 |
|---|
| 7 | EE | John W. Raymond,
Mehran Jalaie,
Mary P. Bradley:
Conditional Probability: A New Fusion Method for Merging Disparate Virtual Screening Results.
Journal of Chemical Information and Modeling 44(2): 601-609 (2004) |
| 2003 |
|---|
| 6 | EE | John W. Raymond,
Peter Willett:
Similarity Searching in Databases of Flexible 3D Structures Using Smoothed Bounded Distance Matrices.
Journal of Chemical Information and Computer Sciences 43(3): 908-916 (2003) |
| 2002 |
|---|
| 5 | EE | John W. Raymond,
Eleanor J. Gardiner,
Peter Willett:
RASCAL: Calculation of Graph Similarity using Maximum Common Edge Subgraphs.
Comput. J. 45(6): 631-644 (2002) |
| 4 | EE | John W. Raymond,
Eleanor J. Gardiner,
Peter Willett:
Heuristics for Similarity Searching of Chemical Graphs Using a Maximum Common Edge Subgraph Algorithm.
Journal of Chemical Information and Computer Sciences 42(2): 305-316 (2002) |
| 3 | EE | John W. Raymond,
Peter Willett:
Effectiveness of graph-based and fingerprint-based similarity measures for virtual screening of 2D chemical structure databases.
Journal of Computer-Aided Molecular Design 16(1): 59-71 (2002) |
| 2 | EE | John W. Raymond,
Peter Willett:
Maximum common subgraph isomorphism algorithms for the matching of chemical structures.
Journal of Computer-Aided Molecular Design 16(7): 521-533 (2002) |
| 1999 |
|---|
| 1 | EE | John W. Raymond,
Tony N. Rogers:
Molecular Structure Disassembly Program (MOSDAP): A Chemical Information Model To Automate Structure-Based Physical Property Estimation.
Journal of Chemical Information and Computer Sciences 39(3): 463-474 (1999) |
