SHAnC
SHAnC (Silica Helices Analysis & Construction) is a collection of scripts used to Construct and Analyze Silica Helices.
- Github : https://github.com/re-gr/SHAnC
Getting Started
-
Construction : the scripts that are used to create an helix or a twisted ribbon
- distorsion.py : create helices and ribbons
- read_write.py : read and write files
- script_analysis.py : analysis (rdf, saturation ...) of structures
- script_cycles.py : cycle analysis of structures (WIP)
-
Torsion : the scripts are used to twist the cuboids to the proper shape. This method should not be used, but is kept here just in case.
- distorsion.py : old version of the script in construction that should be compatible with the other script
- script_launch.py : script to create the systems and input file for the simulations
Depedencies
numpy
scipy
matplotlib
pyvista
lammps (optional, for torsion only)
Contact
1 maintainer
Metadata
1 maintainer
Release files for SHAnC 0.0.1.1
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Source distribution (sdist)
| File | Size | Uploaded | Provenance | Actions |
|---|---|---|---|---|
| shanc-0.0.1.1.tar.gz | 4.1 MB | With provenance | Details for shanc-0.0.1.1.tar.gz |
Built distribution (wheel)
| File | Interpreter | ABI | Platform | Actions Reset |
|---|---|---|---|---|
| shanc-0.0.1.1-py3-none-any.whl | Python 3 | none | any | Details for shanc-0.0.1.1-py3-none-any.whl |
Total release size: 8.2 MB
Release files / shanc-0.0.1.1.tar.gz
| Download URL | shanc-0.0.1.1.tar.gz |
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| Size | 4.1 MB |
| Tags | Source |
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| Download URL | shanc-0.0.1.1-py3-none-any.whl |
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| Size | 4.1 MB |
| Tags | Python 3 |
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SHA-256 checksum How to use checksums |
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