A deep learning package for many-body potential energy representation and molecular dynamics

pyiron - an integrated development environment (IDE) for computational materials science.

Generally Applicable Atomic-Charge Dependent London Dispersion Correction

Python module for drawing and rendering beautiful atoms and molecules using Blender.

AdoNetCore.AseClient - a .NET Core DB Provider for SAP ASE

pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LAMMPS. It is almost, but not quite, entirely unlike ASE, with some tools extending numpy/scipy. It has a set of powerful parsers and data types for storing calculation data.

🎨 Read, Inspect, Manipulate, and Save (ASE-only for save) Color Swatch Files

Import colors from macOS CLR, Photoshop ACO/ACT, Illustrator ASE, GIMP GPL, Sketch, Text file to Sketch color variables.

Generating Deep Potential with Python

Python Suite for Advanced General Ensemble Simulations

Nodes Differences Between Shadergraph And AmplifyShaderEditor

reimplementation of the DFT-D3 program

A color palette/gradient reader/writer for a growing set of file formats. Swift (macOS, iOS, tvOS, watchoOS, macCatalyst, Linux)

Convert Procreate Swatches files to ASE format (Adobe Swatch Exchange). Can be used for importing Procreate palettes into Photoshop or other programs like Illustrator or Affinity Designer.

Highly configurable 2D (SVG) & 3D (threejs) visualisations for ASE/Pymatgen structures, within the Jupyter Notebook.

Updated version of Chris Mohler's python-fu script, to import ASE (Kuler, Color CC) palettes into GIMP

Blender ASE Export Script

Python library designed for querying game servers. It supports 24 different query protocols and has been downloaded over 34,000 times.

This project aims to extend the Atomic Simulation Environment (ASE) to more naturally represent the properties of zeolites and facilitate the calculations required to determine their properties.

Python module for drawing and rendering ASE (Atomic Simulation Environment) atoms and molecules objects using blender.