Metadata-Version: 2.4
Name: mdsb
Version: 0.0.1
Summary: MDSB — Molecular Dynamics Simulations of Biomolecules (placeholder pre-release).
Project-URL: Homepage, https://pypi.org/project/mdsb/
Project-URL: Documentation, https://pypi.org/project/mdsb/
Author: Kyriakos Georgiou
License: MIT
License-File: LICENSE
Keywords: biomolecules,computational-chemistry,drug-discovery,md,molecular-dynamics,simulation,trajectory-analysis
Classifier: Development Status :: 2 - Pre-Alpha
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved :: MIT License
Classifier: Programming Language :: Python :: 3
Classifier: Programming Language :: Python :: 3.13
Classifier: Topic :: Scientific/Engineering :: Bio-Informatics
Classifier: Topic :: Scientific/Engineering :: Chemistry
Classifier: Topic :: Scientific/Engineering :: Physics
Requires-Python: >=3.13
Description-Content-Type: text/markdown

# MDSB

**MDSB** (Molecular Dynamics Simulations of Biomolecules) is a Python toolkit for **molecular dynamics (MD) simulations**, **biomolecular modeling**, and **trajectory analysis**.

> This is an initial placeholder release to reserve the project name and provide a minimal, working CLI.  
> Roadmap: system setup, parameterization pipelines, simulation runners, and advanced analysis modules.

## Install
```bash
pip install mdsb

