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Package Creation

Learn how to create a proper Python package that can be installed with pip and shared with others.


Package Structure

A minimal installable package:

mytools/
├── pyproject.toml      # Build configuration (modern)
├── setup.py            # Build configuration (legacy, optional)
├── README.md           # Documentation
├── LICENSE             # License file
├── mytools/            # Source code
│   ├── __init__.py
│   ├── core.py
│   └── utils.py
└── tests/              # Test files
    └── test_core.py

Step 1: Create the Package Directory

mkdir mytools
cd mytools
mkdir mytools tests

Step 2: Write Your Code

mytools/__init__.py

"""mytools - A collection of useful utilities."""

from .core import add, subtract
from .utils import helper

__version__ = "0.1.0"
__all__ = ["add", "subtract", "helper"]

mytools/core.py

"""Core mathematical functions."""

def add(a, b):
    """Add two numbers."""
    return a + b

def subtract(a, b):
    """Subtract b from a."""
    return a - b

mytools/utils.py

"""Utility functions."""

def helper(data):
    """Process data."""
    return [x * 2 for x in data]

Step 3: Create pyproject.toml (Modern)

[build-system]
requires = ["setuptools>=61.0"]
build-backend = "setuptools.build_meta"

[project]
name = "mytools"
version = "0.1.0"
description = "A collection of useful utilities"
readme = "README.md"
license = {text = "MIT"}
requires-python = ">=3.8"
authors = [
    {name = "Your Name", email = "your@email.com"}
]

dependencies = [
    # Add runtime dependencies here
    # "numpy>=1.20",
    # "pandas>=1.3",
]

[project.optional-dependencies]
dev = [
    "pytest>=7.0",
    "black",
    "flake8",
]

[project.urls]
Homepage = "https://github.com/yourusername/mytools"
Documentation = "https://github.com/yourusername/mytools#readme"

[project.scripts]
# Command-line entry points
mytools-cli = "mytools.cli:main"

Step 4: Create setup.py (Legacy/Optional)

For backward compatibility:

from setuptools import setup, find_packages

setup(
    name="mytools",
    version="0.1.0",
    description="A collection of useful utilities",
    author="Your Name",
    author_email="your@email.com",
    packages=find_packages(),
    python_requires=">=3.8",
    install_requires=[
        # "numpy>=1.20",
    ],
)

Step 5: Add README.md

# mytools

A collection of useful utilities.

## Installation

```bash
pip install mytools

Usage

from mytools import add, subtract, helper

print(add(2, 3))        # 5
print(subtract(5, 2))   # 3
print(helper([1, 2, 3])) # [2, 4, 6]

License

MIT

---

## Step 6: Add LICENSE

For MIT License:
MIT License

Copyright (c) 2025 Your Name

Permission is hereby granted, free of charge, to any person obtaining a copy of this software and associated documentation files (the "Software"), to deal in the Software without restriction, including without limitation the rights to use, copy, modify, merge, publish, distribute, sublicense, and/or sell copies of the Software, and to permit persons to whom the Software is furnished to do so, subject to the following conditions:

The above copyright notice and this permission notice shall be included in all copies or substantial portions of the Software.

THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY, FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM, OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE SOFTWARE.

Choose a license at https://choosealicense.com/

---

## Step 7: Install Locally (Development Mode)

```bash
# From the project root (where pyproject.toml is)
pip install -e .

The -e flag means "editable" — changes to source code take effect immediately.

>>> import mytools
>>> mytools.add(2, 3)
5
>>> mytools.__version__
'0.1.0'

Adding Tests

tests/test_core.py

import pytest
from mytools import add, subtract

def test_add():
    assert add(2, 3) == 5
    assert add(-1, 1) == 0
    assert add(0, 0) == 0

def test_subtract():
    assert subtract(5, 3) == 2
    assert subtract(1, 1) == 0

Run tests:

pip install pytest
pytest tests/

Adding CLI Entry Points

mytools/cli.py

import argparse
from . import add, subtract

def main():
    parser = argparse.ArgumentParser(description="mytools CLI")
    parser.add_argument("operation", choices=["add", "subtract"])
    parser.add_argument("a", type=float)
    parser.add_argument("b", type=float)

    args = parser.parse_args()

    if args.operation == "add":
        result = add(args.a, args.b)
    else:
        result = subtract(args.a, args.b)

    print(f"Result: {result}")

if __name__ == "__main__":
    main()

Update pyproject.toml

[project.scripts]
mytools-cli = "mytools.cli:main"

After pip install -e .:

mytools-cli add 2 3
# Result: 5.0

Building for Distribution

Install Build Tools

pip install build twine

Build the Package

python -m build

This creates:

dist/
├── mytools-0.1.0.tar.gz    # Source distribution
└── mytools-0.1.0-py3-none-any.whl  # Wheel (binary)


Publishing to PyPI

1. Create PyPI Account

Register at https://pypi.org/account/register/

2. Upload with Twine

# Test PyPI first (recommended)
twine upload --repository testpypi dist/*

# Production PyPI
twine upload dist/*
# Create token at https://pypi.org/manage/account/token/
twine upload --username __token__ --password pypi-XXXXX dist/*

requirements.txt vs pyproject.toml

File Purpose
pyproject.toml Package metadata and dependencies for installation
requirements.txt Exact versions for reproducible environments

requirements.txt

numpy==1.24.0
pandas==2.0.0
pytest==7.4.0

Generate from installed packages:

pip freeze > requirements.txt

Install from file:

pip install -r requirements.txt

Complete Project Structure

mytools/
├── pyproject.toml
├── setup.py              # Optional (legacy)
├── README.md
├── LICENSE
├── requirements.txt      # For development
├── .gitignore
├── mytools/
│   ├── __init__.py
│   ├── __main__.py       # For `python -m mytools`
│   ├── core.py
│   ├── utils.py
│   └── cli.py
├── tests/
│   ├── __init__.py
│   ├── test_core.py
│   └── test_utils.py
└── docs/
    └── index.md

.gitignore

__pycache__/
*.pyc
*.egg-info/
dist/
build/
.eggs/
*.egg
.pytest_cache/
.venv/
venv/

mytools/__main__.py

"""Allow running as `python -m mytools`."""
from .cli import main

if __name__ == "__main__":
    main()

Summary

Step Command/File
Create structure mkdir mytools && cd mytools
Write code mytools/__init__.py, mytools/core.py
Configure build pyproject.toml
Install locally pip install -e .
Run tests pytest tests/
Build python -m build
Publish twine upload dist/*

Key Takeaways

  • Use pyproject.toml for modern package configuration
  • pip install -e . for editable/development installation
  • Export public API in __init__.py
  • Add __main__.py for python -m package support
  • Use [project.scripts] for CLI entry points
  • Build with python -m build, publish with twine