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1. H-Bond-Distributions H-Bond-Distributions Public

   A general program for identifying and histogramming Hydrogen Bond Distributions.

   Python

2. My-Code-Collection My-Code-Collection Public

   A repository to store a variety of codes

   Python 1

3. Direct_Calculation_Fluctuations Direct_Calculation_Fluctuations Public

   This is a code to calculate activation energies and activation volume using the methods described in Piskulich, Mesele and Thompson, "Removing the Barrier to the Calculation of Activation Energies:…

   Python 1

4. Generalized-Replica-Exchange Generalized-Replica-Exchange Public

   A python wrapper for setting up, running, and analyzing gREM simulations with LAMMPS.

   Python 1

5. EmpiricalMapping EmpiricalMapping Public

   This is a code for generating empirical maps from molecular dynamics simulations (and electronic structure calculations).

   Python 1

6. pair-distribution-derivatives pair-distribution-derivatives Public

   Python 1