Computational and experimental investigations of biologically interesting molecules

Stewart, Matthew Blair (2009) Computational and experimental investigations of biologically interesting molecules. PhD thesis, Victoria University.


The reconciliation of experimental and computational data is an on-going challenge in many fields of scientific enquiry. This is particularly true in chemistry, especially with respect to biologically interesting molecules, given the myriad of problems that now lend themselves to theoretical investigation. This work sampled several areas of this greater landscape using various computational methods, and compared these results to relevant, experimentally derived data.

Item type Thesis (PhD thesis)
Subjects Historical > RFCD Classification > 250000 Chemical Sciences
Historical > RFCD Classification > 320000 Medical and Health Sciences
Historical > Faculty/School/Research Centre/Department > School of Engineering and Science
Keywords biologically interesting molecules, computational investigations, experimental investigations, hydrxoyquinoline derivatives, electrospray ionisation mass spectroscopy, clioquinol, Parkinson's disease, deoxyguanosine, steric interactions
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