enhanced sampling with the dimer

ZofiaTr / DFM

DFM is Python based code using diffusion-map directed sampling to explore the Boltzmann distribution. It uses Openmm for molecular dynamics simulation. Currently under development.

MIT License

1 stars 0 forks source link

enhanced sampling with the dimer #7

Closed ZofiaTr closed 6 years ago

ZofiaTr commented 6 years ago

nop