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chemonaut: An open-source library for exploring chemical and reaction space
Create molecular simulation and machine learning workflows to predict chemical properties and reactivity.
pip install chemonaut
Some example code:
import chemonaut as cn
# example python code
1 maintainer
Release files for chemonaut 0.1.0
For a detailed explanation of source distributions (sdists) and built distributions (wheels), please see the package formats documentation.
Source distribution (sdist)
| File | Size | Uploaded | |
|---|---|---|---|
| chemonaut-0.1.0.tar.gz | 2.0 kB | Details |
Built distribution (wheel)
| File | Interpreter | ABI | Platform | Reset |
|---|---|---|---|---|
| chemonaut-0.1.0-py3-none-any.whl | Python 3 | none | any | Details |
Total release size: 4.4 kB
Release files / chemonaut-0.1.0.tar.gz
| Download URL | chemonaut-0.1.0.tar.gz |
|---|---|
| Size | 2.0 kB |
| Tags | Source |
|
SHA-256 checksum How to use checksums |
7a9700afd2af6fa906e8fd91151177139d9349007781abcaaa59623e6397d2c5
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BLAKE2b-256 checksum How to use checksums |
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|
| Upload date | |
|
Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
poetry/1.7.1 CPython/3.11.4 Darwin/23.1.0
|
Release files / chemonaut-0.1.0-py3-none-any.whl
| Download URL | chemonaut-0.1.0-py3-none-any.whl |
|---|---|
| Size | 2.4 kB |
| Tags | Python 3 |
|
SHA-256 checksum How to use checksums |
b1d67a601c5da12e4054a5ea80e78b03cb61043d484fdcae65bec3a0d71b17e3
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|
BLAKE2b-256 checksum How to use checksums |
3ced6473dcbb243a4e3f186a31ea4488ccc57a7cbf2941817b070335d3cb1c5f
|
| Upload date | |
|
Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
poetry/1.7.1 CPython/3.11.4 Darwin/23.1.0
|
