pymatgen
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines classes for structures and molecules with support for many electronic structure codes. It powers the Materials Project. (by materialsproject)
websocket-client
WebSocket client for Python (by liris)
| pymatgen | websocket-client | |
|---|---|---|
| 5 | 3 | |
| 1,370 | 3,461 | |
| 2.4% | 0.8% | |
| 9.8 | 7.9 | |
| 4 days ago | 5 days ago | |
| Python | Python | |
| GNU General Public License v3.0 or later | Apache License 2.0 |
The number of mentions indicates the total number of mentions that we've tracked plus the number of user suggested alternatives.
Stars - the number of stars that a project has on GitHub. Growth - month over month growth in stars.
Activity is a relative number indicating how actively a project is being developed. Recent commits have higher weight than older ones.
For example, an activity of 9.0 indicates that a project is amongst the top 10% of the most actively developed projects that we are tracking.
Stars - the number of stars that a project has on GitHub. Growth - month over month growth in stars.
Activity is a relative number indicating how actively a project is being developed. Recent commits have higher weight than older ones.
For example, an activity of 9.0 indicates that a project is amongst the top 10% of the most actively developed projects that we are tracking.
pymatgen
Posts with mentions or reviews of pymatgen.
We have used some of these posts to build our list of alternatives
and similar projects.
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Robust references for computational chemistry and python
Pymatgen https://pymatgen.org
- materialsproject/pymatgen: Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.
- Any beginner to intermediate level python program projects that are CHEMISTRY based?
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using VASP without a license
Not aware of anything that would let you run a bootleg/free version of VASP. I might recommend you read this book by J.G. Lee (look for the 2nd edition). You may or may not be able to find a PDF of the text somewhere on the web. The book has several walk-throughs for some simple VASP calculations and details on the input files (POSCAR, INCAR, etc.). This might be a good way to start. Running a VASP calculation is easy enough, it is important to understand the limitations of DFT and what you can/cannot simulate. I would also strongly recommend familiarizing yourself with pymatgen. It is a python package with lots of useful tools from working with materials in a digital format and has many integrations with VASP (and other computational material science tools)
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Another error on pymatgen
If you have issues with Pymatgen, you are better off posting an issue on their GitHub page if it's a bug or on the MatSci Discourse if you have questions.
websocket-client
Posts with mentions or reviews of websocket-client.
We have used some of these posts to build our list of alternatives
and similar projects. The last one was on 2023-01-01.
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RoonCommandLine Version 2.0.8 Release 1
One other significant improvement in RoonCommandLine is an upgrade to the latest WebSocket client library.
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Sending data to django channels groups via django views
EDIT: I could send the message using the websocket-client from the view
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Everything about APIs
Websockets are (usually) for server to browser communication. The server hosts a WebSocket server, and clients can open a connection to that server. This is popular now mostly because it is faster and less resource-hogging than older ways of solving the problem, like long-polling/COMET. It is possible to connect 2 servers using websockets, but that is not usually what they are used for.