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Prediction of good reaction coordinates and future evolution of MD trajectories using Regularized Sparse Autoencoders: A novel deep learning approach.
Abhijit Gupta
Arnab Mukherjee
Published in:
CoRR (2022)
Keyphrases
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deep learning
restricted boltzmann machine
deep belief networks
unsupervised feature learning
unsupervised learning
machine learning
denoising
deep architectures
weakly supervised
sparse coding
mental models
decision trees
moving objects
high dimensional
higher order
sparse representation