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Rigid Body Flows for Sampling Molecular Crystal Structures

Rigid Body Flows for Sampling Molecular Crystal Structures

Valence Labs via YouTube Direct link

- Intro

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Rigid Body Flows for Sampling Molecular Crystal Structures

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  1. 1 - Intro
  2. 2 - Motivations
  3. 3 - Flows on Rigid Bodies
  4. 4 - Sign-Equivariant Flows
  5. 5 - Two Implementations: Moebius Flows & Convex Gradient Maps
  6. 6 - Experiments
  7. 7 - Q+A

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