Zincware

All

36 repositories

massband
Public
Python
•
MIT License
•1•1•4•4•Updated Sep 16, 2025Sep 16, 2025
ZnDraw
Public
Display and Edit Molecules (https://zndraw.icp.uni-stuttgart.de)
python threejs molecule-viewer
TypeScript
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Eclipse Public License 2.0
•5•46•100•6•Updated Sep 16, 2025Sep 16, 2025
paraffin
Public
Python
•
Apache License 2.0
•2•8•24•3•Updated Sep 15, 2025Sep 15, 2025
ZnSocket
Public
Python implementation of a Redis-compatible API using websockets.
redis database nosql key-value websocket cache socketio low-latency
Python
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Apache License 2.0
•2•5•26•4•Updated Sep 15, 2025Sep 15, 2025
znfields
Public
Python
•
Apache License 2.0
•0•1•2•1•Updated Sep 15, 2025Sep 15, 2025
rdkit2ase
Public
Create atomistic structures with ASE, rdkit and packmol
rdkit packmol ase
Python
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Apache License 2.0
•1•15•4•2•Updated Sep 15, 2025Sep 15, 2025
laufband
Public
Parallel Iteration with File-Based Coordination
Python
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MIT License
•0•7•8•1•Updated Sep 15, 2025Sep 15, 2025
ZnTrack
Public
Create, visualize, run & benchmark DVC pipelines in Python & Jupyter notebooks.
git data-science machine-learning developer-tools reproducibility data-version-control dvc python
Python
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Apache License 2.0
•4•53•116•12•Updated Sep 15, 2025Sep 15, 2025
ZnJSON
Public
Package to Encode/Decode some common file formats to json
serialization deserialization python json
Python
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Apache License 2.0
•1•4•6•3•Updated Sep 15, 2025Sep 15, 2025
ZnH5MD
Public
ZnH5MD - High Performance Interface for H5MD Trajectories
science molecular-dynamics h5py trajectory-analysis h5md tensorflow-datasets
Python
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Apache License 2.0
•0•13•19•3•Updated Sep 15, 2025Sep 15, 2025
ZnFlow
Public
A general purpose framework for building and running computational graphs.
workflow networkx computational-graphs networkx-graph directed-acyclic-graph python python3
Python
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Apache License 2.0
•0•6•19•5•Updated Sep 15, 2025Sep 15, 2025
IPSuite
Public
Machine Learned Interatomic Potential Tools
machine-learning physics molecular-dynamics zntrack
Python
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Eclipse Public License 2.0
•11•24•64•18•Updated Sep 15, 2025Sep 15, 2025
MDSuite
Public
A post-processing engine for particle simulations
tensorflow molecular-dynamics hdf5 particle-simulation python
Python
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Eclipse Public License 2.0
•10•45•60•10•Updated Aug 20, 2025Aug 20, 2025
ZnPINNLab
Public
Jupyter Notebook
•0•1•4•0•Updated Jun 30, 2025Jun 30, 2025
rclone-filesystem
Public
Python
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Apache License 2.0
•0•1•0•0•Updated Jun 13, 2025Jun 13, 2025
znmdakit
Public
Python
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Apache License 2.0
•0•1•8•1•Updated Jun 9, 2025Jun 9, 2025
ips-mace
Public archive
IPSuite node(s) for the MACE model
Python
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Eclipse Public License 2.0
•0•0•1•5•Updated Feb 11, 2025Feb 11, 2025
papyrus
Public
Record your models.
Python
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Eclipse Public License 2.0
•0•3•1•1•Updated Jan 22, 2025Jan 22, 2025
ZnNL
Public
A Python package for studying neural learning
data-science physics mathematics machinelearning data-selection
Python
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Eclipse Public License 2.0
•1•8•21•6•Updated Dec 18, 2024Dec 18, 2024
ips-kernelselect
Public
Python
•
Eclipse Public License 2.0
•0•0•0•0•Updated Nov 27, 2024Nov 27, 2024
ZnInit
Public archive
Python
•
Apache License 2.0
•0•0•4•3•Updated Nov 11, 2024Nov 11, 2024
ZnVis
Public
A visualisation engine for particle simulations
visualization particles 3d open3d
Python
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Eclipse Public License 2.0
•3•10•8•4•Updated Sep 18, 2024Sep 18, 2024
ips-nequip
Public archive
IPSuite node(s) for the NEquIP model
Python
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Eclipse Public License 2.0
•0•0•1•1•Updated Sep 4, 2024Sep 4, 2024
dask4dvc
Public archive
Use dask to run the DVC Graph
Python
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Apache License 2.0
•0•16•13•6•Updated Jul 18, 2024Jul 18, 2024
ipsuite-core
Public archive
Python
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Apache License 2.0
•0•1•0•6•Updated Jul 15, 2024Jul 15, 2024
ZnFrame
Public archive
Python
•0•0•1•3•Updated Jun 17, 2024Jun 17, 2024
aaargs
Public
attribute autocompletion and argument parsing
python parser
Python
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Apache License 2.0
•0•4•0•1•Updated Mar 20, 2024Mar 20, 2024
znlib
Public
The znlib package
Python
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Apache License 2.0
•0•3•1•6•Updated Mar 9, 2023Mar 9, 2023
ZnSlice
Public
Python
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Apache License 2.0
•0•1•2•1•Updated Feb 27, 2023Feb 27, 2023
SymSuite
Public
A python package using machine learning to study symmetry.
machine-learning symmetry group-theory lie-algebra
Python
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Eclipse Public License 2.0
•0•9•0•3•Updated Sep 14, 2022Sep 14, 2022