Ecosyste.ms: Awesome

An open API service indexing awesome lists of open source software.

Awesome Lists | Featured Topics | Projects

https://github.com/njzjz/openbabel-wheel


https://github.com/njzjz/openbabel-wheel

Last synced: about 1 month ago
JSON representation

Awesome Lists containing this project

README

        

# openbabel-wheel

[![Pypi version](https://img.shields.io/pypi/v/openbabel-wheel)](https://pypi.org/project/openbabel-wheel/)
[![Pypi downloads](https://img.shields.io/pypi/dm/openbabel-wheel)](https://pypi.org/project/openbabel-wheel/)
[![Pypi downloads](https://img.shields.io/pypi/dw/openbabel-wheel)](https://pypi.org/project/openbabel-wheel/)
[![Pypi downloads](https://img.shields.io/pypi/dd/openbabel-wheel)](https://pypi.org/project/openbabel-wheel/)

`openbabel-wheel` is an unofficial repository to distribute OpenBabel prebuilt wheels through Pypi using

```sh
pip install openbabel-wheel
```

The package requires Python 3.7 and above.

The project is inspired by [rdkit-pypi](https://github.com/kuelumbus/rdkit-pypi) and powered by [scikit-build-core](https://github.com/scikit-build/scikit-build-core) and [cibuildwheel](https://github.com/pypa/cibuildwheel).

## Available Builds

| OS | Arch | Bit | Conditions | Python |
| ------- | ------- | --- | -------------- | ------------- |
| Linux | x86_64 | 64 | glibc >= 2.17 | 3.7-3.13 |
| macOS | x86_64 | 64 | >= macOS-10.9 | 3.7-3.13 |
| macOS | arm64 | 64 | >= macOS-11 | 3.8-3.13 |
| Windows | amd64 | 64 | | 3.8-3.13 |

## Usage

### Python

```py
from openbabel import openbabel
```

### Command line

```sh
obabel -h
```

## License

`openbabel-wheel` distributed under the same [license](LICENSE) as OpenBabel.
For original OpenBabel repository, refer [openbabel/openbabel](https://github.com/openbabel/openbabel).