Theoretical and computational studies of the structure, interactions
and dynamics of biomolecules. Current research interests include:
- Aggregation of disease-linked proteins (Aβ, α-synuclein, SOD1)
- Mechanical unfolding of proteins
- Sampling algorithms and effective force fields
Software/databases:
- ProFASi -
program package for protein folding and aggregation simulations
- HPDesign -
sequence-structure database for HP lattice proteins (updated Nov. 2011)
