MACE: Higher Order Equivariant Message Passing Neural Networks for Fast and Accurate Force Fields.
Ilyes BatatiaDávid Péter KovácsGregor N. C. SimmChristoph OrtnerGábor CsányiPublished in: CoRR (2022)
Keyphrases
- message passing
- higher order
- neural network
- belief propagation
- markov random field
- distributed systems
- pairwise
- probabilistic inference
- factor graphs
- sum product
- inference in graphical models
- distributed shared memory
- shared memory
- artificial neural networks
- sum product algorithm
- approximate inference
- conditional random fields
- back propagation
- matrix multiplication
- objective function
- graph cuts
- junction tree
- max product
- high quality
- image processing