Zincware
Open source software organisation hosting software built for computational physics and chemistry.
Germany
Pinned Repositories
dask4dvc
Use dask to run the DVC Graph
IPSuite
Machine Learned Interatomic Potential Tools
MDSuite
A post-processing engine for particle simulations
rdkit2ase
SymSuite
A python package using machine learning to study symmetry.
ZnDraw
Display and Edit Molecules (https://zndraw.icp.uni-stuttgart.de)
ZnH5MD
ZnH5MD - High Performance Interface for H5MD Trajectories
ZnNL
A Python package for studying neural learning
ZnTrack
Create, visualize, run & benchmark DVC pipelines in Python & Jupyter notebooks.
ZnVis
A visualisation engine for particle simulations
Zincware's Repositories
zincware/ZnTrack
Create, visualize, run & benchmark DVC pipelines in Python & Jupyter notebooks.
zincware/MDSuite
A post-processing engine for particle simulations
zincware/ZnDraw
Display and Edit Molecules (https://zndraw.icp.uni-stuttgart.de)
zincware/IPSuite
Machine Learned Interatomic Potential Tools
zincware/dask4dvc
Use dask to run the DVC Graph
zincware/rdkit2ase
zincware/ZnVis
A visualisation engine for particle simulations
zincware/SymSuite
A python package using machine learning to study symmetry.
zincware/ZnH5MD
ZnH5MD - High Performance Interface for H5MD Trajectories
zincware/ZnNL
A Python package for studying neural learning
zincware/paraffin
zincware/ZnFlow
A general purpose framework for building and running computational graphs.
zincware/aaargs
attribute autocompletion and argument parsing
zincware/papyrus
Record your models.
zincware/ZnJSON
Package to Encode/Decode some common file formats to json
zincware/znlib
The znlib package
zincware/ZnSocket
Python implementation of a Redis-compatible API using websockets.
zincware/DataHub
zincware/dot4dict
Access dictionary keys with a dot
zincware/ipsuite-core
zincware/znfields
zincware/ZnInit
zincware/ZnSlice
zincware/ZnFrame
zincware/ZnPINNLab
zincware/.github
Public organisation repo
zincware/ips-kernelselect
zincware/ips-mace
IPSuite node(s) for the MACE model
zincware/ips-nequip
IPSuite node(s) for the NEquIP model
zincware/ZincHub
Api to access the zincwarecode Datahub.