DiSCO: Diffusion Schrödinger Bridge for Molecular Conformer Optimization.
Danyeong LeeDohoon LeeDongmin BangSun KimPublished in: AAAI (2024)
Keyphrases
- heat equation
- distance transform
- hamilton jacobi
- steady state
- diffusion process
- wave equation
- optimization method
- partial differential equations
- scale spaces
- optimization algorithm
- optimization problems
- scale space
- heat kernel
- optimization methods
- diffusion processes
- global optimization
- optimization process
- image processing
- diffusion model
- finite difference
- shape analysis
- level set
- multi objective
- eikonal equation
- evolutionary algorithm