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Physical Sciences and Mathematics Commons™
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Full-Text Articles in Physical Sciences and Mathematics
Predicting Biomolecular Properties And Interactions Using Numerical, Statistical And Machine Learning Methods, Elyssa Sliheet
Predicting Biomolecular Properties And Interactions Using Numerical, Statistical And Machine Learning Methods, Elyssa Sliheet
Mathematics Theses and Dissertations
We investigate machine learning and electrostatic methods to predict biophysical properties of proteins, such as solvation energy and protein ligand binding affinity, for the purpose of drug discovery/development. We focus on the Poisson-Boltzmann model and various high performance computing considerations such as parallelization schemes.
Automated Identification And Mapping Of Interesting Mineral Spectra In Crism Images, Arun M. Saranathan
Automated Identification And Mapping Of Interesting Mineral Spectra In Crism Images, Arun M. Saranathan
Doctoral Dissertations
The Compact Reconnaissance Imaging Spectrometer for Mars (CRISM) has proven to be an invaluable tool for the mineralogical analysis of the Martian surface. It has been crucial in identifying and mapping the spatial extents of various minerals. Primarily, the identification and mapping of these mineral spectral-shapes have been performed manually. Given the size of the CRISM image dataset, manual analysis of the full dataset would be arduous/infeasible. This dissertation attempts to address this issue by describing an (machine learning based) automated processing pipeline for CRISM data that can be used to identify and map the unique mineral signatures present in …