Skip to content

Folders and files

NameName
Last commit message
Last commit date

Latest commit

 

History

12 Commits
 
 

Repository files navigation

linkedin @jhymel google scholar


Current project(s)

  • MM_base: Libraries for running basic molecular dynamics (MD) simulations in OpenMM
  • Fixed_Voltage_OpenMM: Libraries for simulating an electrode/electrolyte interface under applied voltage
  • QM/MM/MD: Libraries for fantastic QM/MM dynamics code written by John Pederson using Psi4 and OpenMM
  • WHAM: Implementations of the Weighted Histogram Analysis Method (WHAM) in 1D and 2D
  • Well-sliced Metadynamics Reweighting: Code for reweighting biased simulations incorporating combined metadynamics and umbrella sampling

About

Personal repository associated with Github profile banner.

Resources

Stars

2 stars

Watchers

1 watching

Forks

Releases

Packages

Contributors