amepproject / amepLinks
The Active Matter Evaluation Package (AMEP) - a Python library for the analysis of particle-based and continuum simulation data of soft and active matter systems
☆21Updated 2 months ago
Alternatives and similar repositories for amep
Users that are interested in amep are comparing it to the libraries listed below
Sorting:
- Benchmark CPUs and GPUs by running molecular dynamics simulations in LAMMPS☆15Updated 2 years ago
- ☆14Updated 6 years ago
- Polymer Self-Consistent Field Theory (C++/CUDA version)☆36Updated this week
- An interactive structure viewer alongside its simulated diffraction pattern☆18Updated 2 weeks ago
- LAMMPS tutorials for both beginners and advanced users: the article☆27Updated 2 weeks ago
- An python script implementation to solve classical Density Functional Theory for Lennard-Jones fluids on 1D and 3D geometries☆20Updated 10 months ago
- A Python module for fast computation of 2D and 3D radial distribution functions (RDFs).☆31Updated last year
- Python Multiscale Thermochemistry Toolbox (pMuTT)☆47Updated last month
- ☆34Updated 10 months ago
- A Python package to compute bond orientational order parameters as defined by Steinhardt, Physical Review B (1983)☆31Updated 7 years ago
- A Python package for estimating diffusion properties from molecular dynamics simulations.☆73Updated last week
- A python package for classical Density Functional Theory (cDFT). This package allows you to find the equilibrium density profile of an in…☆26Updated 3 years ago
- JAX-ReaxFF: A Gradient Based Framework for Extremely Fast Optimization of Reactive Force Fields☆66Updated 11 months ago
- NIST Interatomic Potential Repository property calculation tools☆12Updated 3 weeks ago
- Builder for molecular systems☆17Updated 5 months ago
- Massively parallel hybrid particle-field molecular dynamics in Python.☆29Updated 11 months ago
- A framework for processing adsorption data and isotherm fitting☆74Updated 5 months ago
- Interactive Jupyter Notebooks for learning the fundamentals of Density-Functional Theory (DFT)☆73Updated 2 months ago
- Python interface for Enhanced Monte Carlo (EMC)☆20Updated last week
- A classical Density Functional Theory code to calculate the properties of hard spheres or Lennard-Jones particles in planar geometry i.e.…☆17Updated 6 months ago
- Quick Uncertainty and Entropy via STructural Similarity☆47Updated 2 months ago
- Python-based tool to calculate instantaneous interfaces and concentration/orientation profiles from molecular simulation trajectories in …☆12Updated 5 years ago
- A scalable and versatile library to generate representations for atomic-scale learning☆82Updated last year
- This app is an ASE-base workflow used to reproduce a rational initial SEI morphology at the atomic scale by stochastically placing the cr…☆11Updated 2 weeks ago
- A post-processing engine for particle simulations☆45Updated last week
- On-the-fly calculation of Transport Properties☆26Updated 2 years ago
- Tool for finding atomic environments in crystal structures☆22Updated 3 months ago
- Grand canonical optimization of grain boundary phases.☆26Updated 3 months ago
- Calculates 3d structure factor and simulated x-ray diffraction pattern from molecular dynamics trajectories☆17Updated 5 years ago
- A set of utilities and pedagogic notebooks for the use of linear and kernel methods in atomistic modeling☆23Updated last year