Publications

Barnaba: software for analysis of nucleic acid structures and trajectories

Publications

3D Steerable CNNs: Learning Rotationally Equivariant Features in Volumetric Data

Publications

Monte Carlo Sampling of Protein Folding by Combining an All-Atom Physics-Based Model with a Native State Bias

Publications

Driving Structural Transitions in Molecular Simulations Using the Nonequilibrium Candidate Monte Carlo

Publications

Spherical convolutions and their application in molecular modelling