research
∙
07/01/2020
Molecular Latent Space Simulators
Small integration time steps limit molecular dynamics (MD) simulations t...
share
research
∙
06/12/2019
High-resolution Markov state models for the dynamics of Trp-cage miniprotein constructed over slow folding modes identified by state-free reversible VAMPnets
State-free reversible VAMPnets (SRVs) are a neural network-based framewo...
research
∙
06/02/2019
Capabilities and Limitations of Time-lagged Autoencoders for Slow Mode Discovery in Dynamical Systems
Time-lagged autoencoders (TAEs) have been proposed as a deep learning re...
research
∙
02/09/2019