2005 |
4 | EE | Ralph T. Mosley,
J. Christopher Culberson,
Bryan Kraker,
Bradley P. Feuston,
Robert P. Sheridan,
John F. Conway,
Joseph K. Forbes,
Subhas J. Chakravorty,
Simon K. Kearsley:
Reagent Selector: Using Synthon Analysis to Visualize Reagent Properties and Assist in Combinatorial Library Design.
Journal of Chemical Information and Modeling 45(5): 1439-1446 (2005) |
2004 |
3 | EE | Robert P. Sheridan,
Bradley P. Feuston,
Vladimir N. Maiorov,
Simon K. Kearsley:
Similarity to Molecules in the Training Set Is a Good Discriminator for Prediction Accuracy in QSAR.
Journal of Chemical Information and Modeling 44(6): 1912-1928 (2004) |
2003 |
2 | EE | Vladimir Svetnik,
Andy Liaw,
Christopher Tong,
J. Christopher Culberson,
Robert P. Sheridan,
Bradley P. Feuston:
Random Forest: A Classification and Regression Tool for Compound Classification and QSAR Modeling.
Journal of Chemical Information and Computer Sciences 43(6): 1947-1958 (2003) |
2001 |
1 | EE | Bradley P. Feuston,
Michael D. Miller,
J. Christopher Culberson,
Robert B. Nachbar,
Simon K. Kearsley:
Comparison of Knowledge-Based and Distance Geometry Approaches for Generation of Molecular Conformations.
Journal of Chemical Information and Computer Sciences 41(3): 754-763 (2001) |