Search Results for author:
Found 4 papers, 0 papers with code
QUBO Decision Tree: Annealing Machine Extends Decision Tree Splitting
This paper proposes an extension of regression trees by quadratic unconstrained binary optimization (QUBO).
QUBO-inspired Molecular Fingerprint for Chemical Property Prediction
We generate new fingerprints based on the assumption that a performance of prediction using a more effective fingerprint is better.
Proposing Novel Extrapolative Compounds by Nested Variational Autoencoders
To generate high performance compounds beyond the range of the training data, the authors also proposed a loss function that amplifies the correlation between a component of latent variables of the inner VAE and material properties.
Accelerating small-angle scattering experiments with simulation-based machine learning
Making material experiments more efficient is a high priority for materials scientists who seek to discover new materials with desirable properties.
Cannot find the paper you are looking for? You can
Submit a new open access paper.
