Interpretable Supervised Learning and Graph-Based Optimization for Glycan-Lectin Binding

Non-linear biological macromolecules, such as glycans, participate in a wide range of key structural, metabolic, and regulatory functions in all living organisms. Many of these essential roles involve interactions with glycan-binding proteins called lectins. As a result, there is particular interest...

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Bibliographic Details
Main Author: An, Joyce
Other Authors: Gomez-Bombarelli, Rafael
Format: Thesis
Published: Massachusetts Institute of Technology 2024
Online Access:https://hdl.handle.net/1721.1/153781