LoLab-MSM / PyBILT
Toolkit to aid in the analysis of lipid bilayer molecular simulation trajectories.
☆24Updated 3 years ago
Alternatives and similar repositories for PyBILT:
Users that are interested in PyBILT are comparing it to the libraries listed below
- Dynamic Histogram Analysis To Determine Free Energies and Rates from Biased Simulations☆20Updated 7 years ago
- Experimental small molecule hydration free energy dataset☆30Updated 2 years ago
- A python module for flexible Poisson-Boltzmann based pKa calculations with proton tautomerism☆58Updated last year
- Best Practices article intended for LiveCoMS☆39Updated 5 years ago
- A fast solver for large scale MBAR/UWHAM equations☆38Updated 6 months ago
- Compare optimized geometries and energies from various force fields with respect to a QM reference.