molsystem
Project description
MolSystem
Molsystem provides a general class for handling molecular and periodic systems
Free software: GNU Lesser General Public License v3+
Documentation: https://molsystem.readthedocs.io.
Features
Complete the initial version!
Remove the coordinates from the Atoms class and allow for multiple sets of coordinates – conformers, trajectories, etc.
Provide a concept of the ‘current’ system
Credits
This package was created with Cookiecutter and the audreyr/cookiecutter-pypackage project template.
History
0.1.0 (2019-05-05)
First release on PyPI.
Release history Release notifications | RSS feed
Download files
Download the file for your platform. If you're not sure which to choose, learn more about installing packages.
Source Distribution
Built Distribution
Filter files by name, interpreter, ABI, and platform.
If you're not sure about the file name format, learn more about wheel file names.
Copy a direct link to the current filters
File details
Details for the file molsystem-2021.9.11.tar.gz.
File metadata
- Download URL: molsystem-2021.9.11.tar.gz
- Upload date:
- Size: 268.0 kB
- Tags: Source
- Uploaded using Trusted Publishing? No
- Uploaded via: twine/3.4.2 importlib_metadata/4.8.1 pkginfo/1.7.1 requests/2.26.0 requests-toolbelt/0.9.1 tqdm/4.62.2 CPython/3.9.7
File hashes
| Algorithm | Hash digest | |
|---|---|---|
| SHA256 |
663e1ac64075c01b132fdb63e815aa6904e2100069ede4c919539332aadc3dd2
|
|
| MD5 |
1c54fedb1f3c565fae3bf4fff73c2207
|
|
| BLAKE2b-256 |
d40277db12e78c714da6b290226a045fb037e546d52f7ca702a4138b44b9da87
|
File details
Details for the file molsystem-2021.9.11-py2.py3-none-any.whl.
File metadata
- Download URL: molsystem-2021.9.11-py2.py3-none-any.whl
- Upload date:
- Size: 75.0 kB
- Tags: Python 2, Python 3
- Uploaded using Trusted Publishing? No
- Uploaded via: twine/3.4.2 importlib_metadata/4.8.1 pkginfo/1.7.1 requests/2.26.0 requests-toolbelt/0.9.1 tqdm/4.62.2 CPython/3.9.7
File hashes
| Algorithm | Hash digest | |
|---|---|---|
| SHA256 |
c72bd08b01cd3219bf6fe1c2791b94b1a6db54cd4c13d8abe8b0944570e10569
|
|
| MD5 |
b3453d850d377645c34b50f4b9ffd605
|
|
| BLAKE2b-256 |
862df0d027933d900cb59b4329e1def1a0bd3f65299d0c30f6790a742f8c081a
|
