How Math and AI Are Revolutionizing Biosciences

How Math and AI Are Revolutionizing Biosciences

Applied Algebraic Topology Network via YouTube Direct link

Algebraic Graph Theory for Biomolecules

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16 of 28

Algebraic Graph Theory for Biomolecules

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How Math and AI Are Revolutionizing Biosciences

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  1. 1 Intro
  2. 2 COVID-19 demonstrates the importance of biosciences
  3. 3 Challenges of AI in biomolecular systems Geometric dimensionality where N-5000 for a protein.
  4. 4 Two schools of thinking
  5. 5 Our Strategy
  6. 6 Classical Topology Mobius Strips (1858) Klein Bottle (1882)
  7. 7 Topological invariants: Betti numbers
  8. 8 Vietoris-Rips complexes of planar point sets
  9. 9 Algebraic Topology Vietoris-Rips complexes, persistent homology and topological fingerprint
  10. 10 Topological fingerprints of an alpha helix
  11. 11 Persistent cohomology incorporating non-geometric information in topology
  12. 12 Differential geometry based minimal surface model
  13. 13 Differential Geometry (Connections & curvature forms) Gauss Mean
  14. 14 De Rham-Hodge theory and discrete exterior calculus Hodge decomposition
  15. 15 Evolutionary de Rham-Hodge Filtration of a manifold
  16. 16 Algebraic Graph Theory for Biomolecules
  17. 17 Persistent Spectral Graph (Persistent Laplacian)
  18. 18 Mathematical deep learning
  19. 19 Drug Design Data Resource (D3R) Grand Challenges
  20. 20 Life cycle of SARS-CoV-2 in host cells
  21. 21 Mutation Tracker
  22. 22 Mutations Strengthened SARS
  23. 23 We predicted key mutation sites in prevailing variants Mutations at 501 and 452 in prevailing SARS-CoV-2 variants
  24. 24 We discovered the mechanism of viral transmission and evolution
  25. 25 Mutation-induced binding free energy changes for spike protein-ACE-2 complex (more infectious)
  26. 26 Genome-Math-Al modeling of protein-protein binding affinity changes following mutations
  27. 27 Atlas of emerging variants
  28. 28 Geometric Differential topology topology

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