ChemistryAi
Github
ChemistryAi is a simple Python library for:
- Parsing SMILES strings into graph structures.
- Generating IUPAC names for monocyclic and acyclic compounds with functional groups
- Visualizing molecules with RDKit.
- Comparing stability and acidic strength of compounds
Installation
pip install chemistryai
1 maintainer
Download files
Download the file for your platform. If you're not sure which to choose, learn more about installing packages.
Source Distribution
chemistryai-0.2.6.tar.gz
(19.9 kB
view details)
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 chemistryai-0.2.6.tar.gz.
File metadata
- Download URL: chemistryai-0.2.6.tar.gz
- Upload date:
- Size: 19.9 kB
- Tags: Source
- Uploaded using Trusted Publishing? No
- Uploaded via:
twine/6.2.0 CPython/3.12.4
File hashes
| Algorithm | Hash digest | |
|---|---|---|
| SHA256 |
ab46e1a9c7143a2e9d0cf54bec48613bced6c5d5cb51ac109a08497909661cd3
|
|
| MD5 |
ac6914ce7f875e7d24b14dfd3ea043dc
|
|
| BLAKE2b-256 |
31acec41af251e458b39e911337f7c696e6bb15c9bbb64c80e2cc7efad97c948
|
File details
Details for the file chemistryai-0.2.6-py3-none-any.whl.
File metadata
- Download URL: chemistryai-0.2.6-py3-none-any.whl
- Upload date:
- Size: 19.6 kB
- Tags: Python 3
- Uploaded using Trusted Publishing? No
- Uploaded via:
twine/6.2.0 CPython/3.12.4
File hashes
| Algorithm | Hash digest | |
|---|---|---|
| SHA256 |
90f0b8938dc797ec8191bef86950d05609c8cc616d7b8ffb1b1237c7c6cc4d24
|
|
| MD5 |
908e889e57829283ef600916b216032c
|
|
| BLAKE2b-256 |
b9c504a47e15e6abf482cab7497f1843fe031a69ceb923581d22c357a1fe6f20
|
