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Persistent de Rham-Hodge Laplacians in Eulerian representation for manifold topological learning
Zhe Su1, Yiying Tong2, Guo-Wei Wei1,3,4
1Department of Mathematics, Michigan State University, East Lansing, MI 48824, USA.
We introduce a new method for topological data analysis on manifolds, called persistent Hodge Laplacian (PHL). This approach enables manifold topological learning for machine learning applications, showing promise in predicting protein-ligand binding affinities.
Area of Science:
- Computational topology
- Data science
- Scientific computing
Background:
- Topological data analysis (TDA) and persistent homology are powerful tools, but limited to point cloud data.
- Existing methods for manifold data, like evolutionary de Rham-Hodge theory, suffer from numerical inconsistencies in machine learning contexts.
- There is a need for robust TDA methods applicable to data residing on manifolds.
Purpose of the Study:
- To develop a novel topological learning framework for data defined on manifolds.
- To address the limitations of existing persistent homology methods for manifold-structured data.
- To enable consistent and efficient topological analysis of manifold data in machine learning.
Main Methods:
- Introduction of the persistent de Rham-Hodge Laplacian (PHL) for manifold topological learning.
- Construction of PHLs in the Eulerian representation using structure-persevering Cartesian grids.
- Development of a persistent Hodge Laplacian learning algorithm for manifold and volumetric data.
Main Results:
- PHLs avoid numerical inconsistencies associated with remeshing in Lagrangian representations.
- The proposed method facilitates manifold topological learning on multi-scale manifolds.
- Successful application in predicting protein-ligand binding affinities using benchmark datasets.
Conclusions:
- The persistent Hodge Laplacian offers a robust and numerically consistent approach for topological learning on manifolds.
- This method expands the applicability of TDA to complex, manifold-structured datasets.
- The framework shows significant potential for applications in computational biology and other scientific domains.
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