Characterization-Based Molecular Design of Biofuel Additives Using Chemometric and Property Clustering Techniques
In this work, multivariate characterization data such as infrared (IR) spectroscopy was used as a source of descriptor data involving information on molecular architecture for designing structured molecules with tailored properties. Application of multivariate statistical techniques such as principa...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
Frontiers Media S.A.
2014-06-01
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| Series: | Frontiers in Energy Research |
| Subjects: | |
| Online Access: | http://journal.frontiersin.org/Journal/10.3389/fenrg.2014.00020/full |