Metadata-Version: 2.1
Name: mdtoolbelt
Version: 0.0.1
Summary: Tools por MD post-processing
Home-page: https://github.com/d-beltran/mdtoolbelt
Author: Dani Beltrán
Author-email: d.beltran.anadon@gmail.com
License: UNKNOWN
Project-URL: Bug Tracker, https://github.com/d-beltran/mdtoolbelt/issues
Platform: UNKNOWN
Classifier: Programming Language :: Python :: 3
Classifier: License :: OSI Approved :: MIT License
Requires-Python: >=3.6
Description-Content-Type: text/markdown
License-File: LICENSE

# mdtoolbelt

Tools por MD post-processing

**Important**: PIP only installs the package. All the dependencies must be installed separately. To perform a complete installation, please use ANACONDA.


## Conversions

Convert structure and trajectory files from one format to another

### Python

```python
from mdtoolbelt.conversions import convert

convert(input_trajectory_filename='trajectory.xtc', output_trajectory_filename='trajectory.dcd')
```

### Bash

```bash
mdtb convert -it trajectory.xtc -ot trajectory.dcd
```

