Investigations into Message Passing Neural Networks and Polymer Fouling

This thesis covers the diverse investigations of high-fidelity molecular property prediction with Message Passing Neural Networks (MPNNs) and nanoscale polymer fouling experimentation with Quartz Crystal Microbalances (QCMs). Message Passing Neural Networks are promising deep learning architectu...

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Bibliographic Details
Main Author: Forsuelo, Michael
Other Authors: Green, William H.
Format: Thesis
Published: Massachusetts Institute of Technology 2022
Online Access:https://hdl.handle.net/1721.1/145062