Statistical Mechanics Python Packages

smol

Statistical Mechanics on Lattices

pyerrors

Error propagation and statistical analysis for Monte Carlo simulations in lattice QCD and statistical mechanics using autograd.

leymosun

Leymosun Science: Quantum Research Toolkit

ensemble-md

A python package for performing GROMACS simulation ensembles

infotopo

computes most of information functions (joint entropy, conditional, mutual information, total correlation information distance) and deep information networks

bristol

Parallel random matrix tools and complexity for deep learning

ufjc

The Python package for the uFJC single-chain model.

statmechcrack

Statistical mechanical models for crack growth.

spatialstats

Statistical routines to analyze the spatial structure of 2D and 3D spatial fields and particle distributions.

mumot

Multiscale Modelling Tool - mathematical modelling without the maths

foldamers

Tools to model folding and evaluate thermodynamic properties for polymers and oligomers

replicatedfocusingbeliefpropagation

Replicated Focusing Belief Propagation algorithm

hpsandbox

a package of Python modules and example scripts for experimenting with the two-dimensional HP lattice model of Dill and Chan.