Open AccessA SURROGATE MODEL OF MOLECULAR DYNAMICS SIMULATIONS FOR POLAR FLUIDS: SUPERVISED LEARNING METHODS FOR MOLECULAR POLARIZATION AND UNSUPERVISED METHODS FOR PHASE CLASSIFICATION
Author(s) -
Zackerie W Hjorth
Publication year - 2022
Language(s) - English
Resource type - Dissertations/theses
DOI - 10.37099/mtu.dc.etdr/1358
Subject(s) - artificial intelligence , computer science , artificial neural network , molecular dynamics , machine learning , unsupervised learning , surrogate model , physics , quantum mechanics
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