Process Systems Engineering
Enhancing molecular discovery using descriptor-free rearrangement clustering techniques for sparse data sets
Article first published online: 16 SEP 2009
Copyright © 2009 American Institute of Chemical Engineers (AIChE)
Volume 56, Issue 2, pages 405–418, February 2010
How to Cite
DiMaggio, P. A., McAllister, S. R., Floudas, C. A., Feng, X.-J., Li, G., Rabinowitz, J. D. and Rabitz, H. A. (2010), Enhancing molecular discovery using descriptor-free rearrangement clustering techniques for sparse data sets. AIChE J., 56: 405–418. doi: 10.1002/aic.11986
- Issue published online: 12 JAN 2010
- Article first published online: 16 SEP 2009
- Manuscript Revised: 28 MAY 2009
- Manuscript Received: 16 SEP 2008
- US EPA. Grant Number: GAD R 832721-010
- Environmental Protection Agency's STAR program. Grant Number: R 832721-010
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