Convolutional Recurrent Autoencoder for Molecular-Continuum Coupling.
Piet JarmatzSebastian LerdoPhilipp NeumannPublished in: ICCS (4) (2023)
Keyphrases
- restricted boltzmann machine
- molecular dynamics simulations
- deep learning
- recurrent neural networks
- molecular dynamics
- multi unit combinatorial auctions
- three dimensional
- feed forward
- molecular structure
- sparse coding
- deep belief networks
- neural network
- unsupervised feature learning
- dna computing
- higher order
- semi supervised
- learning algorithm
- interaction networks
- loopy belief propagation
- probabilistic graphical models
- molecular structures
- data sets