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DataFrame API with SQL pushdown execution and real SQL CRUD - the missing layer for SQL in Python

Project description

Moltres

CI Python 3.9+ License: MIT Code style: ruff

The Missing DataFrame Layer for SQL in Python

MOLTRES: Modern Operations Layer for Transformations, Relational Execution, and SQL

InstallationQuick StartDocumentationWhy Moltres?


Moltres fills a major gap in the Python data ecosystem: it's the only library that combines a DataFrame API (like Pandas/Polars), SQL pushdown execution (no data loading into memory), and real SQL CRUD operations (INSERT, UPDATE, DELETE) in one unified interface.

Transform millions of rows using familiar DataFrame operations—all executed directly in SQL without materializing data. Update, insert, and delete with column-aware, type-safe operations. No juggling between Pandas, SQLAlchemy, and raw SQL. Just one library that does it all.

📑 Table of Contents

✨ Features

  • ✏️ Real SQL CRUD - INSERT, UPDATE, DELETE operations with DataFrame-style syntax
  • 🚀 DataFrame API - Familiar operations (select, filter, join, groupBy, etc.) like Pandas/Polars
  • 🗄️ SQL Pushdown Execution - All operations compile to SQL and run on your database—no data loading into memory
  • 📊 Operates Directly on SQL Tables - Transform tables without materialization
  • 🌊 Streaming Support - Handle datasets larger than memory with chunked processing
  • 📊 Multiple Formats - Read/write CSV, JSON, JSONL, Parquet, and more
  • 🔧 Type Safe - Full type hints with strict mypy checking and custom type stubs for dependencies
  • 🎯 Zero Dependencies - Works with just SQLAlchemy (pandas/polars optional)
  • 🔒 Security First - Built-in SQL injection prevention and validation
  • Performance Monitoring - Optional hooks for query performance tracking
  • 🌍 Environment Config - Configure via environment variables for 12-factor apps
  • Async Support - Full async/await support for all operations (optional dependency)

🔥 What Makes Moltres Unique

Moltres is the only Python library that provides:

Feature Pandas/Polars Ibis SQLAlchemy SQLModel Moltres
DataFrame API
SQL Pushdown Execution
Row-Level INSERT/UPDATE/DELETE
Lazy query building ✔ (Polars) ⚠️ ⚠️
Operates directly on SQL tables ⚠️ limited
Column-oriented transformations

The combination of DataFrame API + SQL pushdown + CRUD does not exist anywhere else in Python.

Key Differentiators

  • Only library with DataFrame API + SQL pushdown + CRUD - No other Python library offers this combination
  • No data loading into memory for transformations - All DataFrame operations execute directly in SQL
  • Works with existing SQL infrastructure - No cluster required, works with SQLite, PostgreSQL, MySQL, and more
  • Type-safe CRUD operations - Validated, column-aware INSERT, UPDATE, DELETE with DataFrame-style syntax
  • SQL-first design - Focuses on providing full SQL feature support through a DataFrame API, not replicating every PySpark feature. Features are included only if they map to SQL/SQLAlchemy capabilities and align with SQL pushdown execution.

🆕 What's New

Version 0.6.0

  • Null Handling Convenience Methods - New na property on DataFrame: df.na.drop() and df.na.fill(value) for convenient null handling
  • Random Sampling - New sample(fraction, seed=None) method for random row sampling with dialect-specific SQL compilation
  • Enhanced Type System - New data types: decimal(), uuid(), json(), and interval() helpers with full SQL support and dialect-specific compilation
  • Interval Arithmetic - New date_add() and date_sub() functions for date/time interval operations
  • Join Hints - New hints parameter for join() method to provide query optimization hints
  • Complex Join Conditions - Enhanced join() method to support arbitrary Column expressions in join conditions
  • Query Plan Analysis - New explain(analyze=False) method to return query execution plans
  • Pivot Operations - New pivot() method for data reshaping with cross-dialect compatibility

Version 0.5.0

  • Compressed File Reading - Automatic detection and support for gzip, bz2, and xz compression in CSV, JSON, JSONL, and text file readers (both sync and async)
  • Array/JSON Functions - New functions for working with JSON and array data: json_extract(), array(), array_length(), array_contains(), array_position() with dialect-specific SQL compilation
  • Collect Aggregations - New aggregation functions collect_list() and collect_set() for array aggregation (uses ARRAY_AGG in PostgreSQL, group_concat in SQLite/MySQL)
  • Semi-Join and Anti-Join - New semi_join() and anti_join() methods that compile to efficient EXISTS/NOT EXISTS subqueries
  • MERGE/UPSERT Operations - New merge() method on tables for upsert operations with dialect-specific support (SQLite ON CONFLICT, PostgreSQL MERGE, MySQL ON DUPLICATE KEY)
  • Comprehensive Test Coverage - All new features include full test coverage with execution tests
Previous Releases

Version 0.4.0

  • Strict Type Checking - Full mypy strict mode compliance with comprehensive type annotations
  • Type Stubs for PyArrow - Custom type stubs to provide type information for pyarrow library
  • PEP 561 Compliance - Added py.typed marker file
  • Enhanced Type Safety - Complete type annotations with improved type inference

Version 0.3.0

  • Separation of File Reads and SQL Operations - File readers return Records instead of DataFrame
  • Records Class - New Records and AsyncRecords classes for file data
  • Full Async/Await Support - Complete async API for all operations
  • Async Streaming - Process large datasets asynchronously

Version 0.2.0

  • Environment Variable Support - Configure via environment variables
  • Performance Monitoring Hooks - Track query execution time
  • Enhanced Security - Comprehensive SQL injection prevention
  • Modular Architecture - Refactored file readers

📦 Installation

Requirements

  • Python 3.9+
  • SQLAlchemy 2.0+ (for database connectivity)
  • A supported SQLAlchemy driver (SQLite, PostgreSQL, MySQL, etc.)

Install Moltres

pip install moltres

For optional dependencies:

# For pandas support
pip install moltres[pandas]

# For polars support
pip install moltres[polars]

# For async support (requires async database drivers)
pip install moltres[async]  # Core async support (aiofiles)
pip install moltres[async-postgresql]  # PostgreSQL async (includes async + asyncpg)
pip install moltres[async-mysql]  # MySQL async (includes async + aiomysql)
pip install moltres[async-sqlite]  # SQLite async (includes async + aiosqlite)

# For both pandas and polars
pip install moltres[pandas,polars]

🚀 Quick Start

from moltres import col, connect
from moltres.expressions.functions import sum

# Connect to your database
db = connect("sqlite:///example.db")

# DataFrame operations with SQL pushdown (no data loading into memory)
df = (
    db.table("orders")
    .select()
    .join(db.table("customers").select(), on=[("customer_id", "id")])
    .where(col("customers.active") == True)  # noqa: E712
    .group_by("customers.country")
    .agg(sum(col("orders.amount")).alias("total_amount"))
)

# Execute and get results (SQL is compiled and executed here)
results = df.collect()  # Returns list of dicts by default

# CRUD operations with DataFrame-style syntax
customers = db.table("customers")

# Insert rows (batch optimized)
customers.insert([
    {"id": 1, "name": "Alice", "email": "alice@example.com", "active": 1},
    {"id": 2, "name": "Bob", "email": "bob@example.com", "active": 0},
])

# Update rows (executes UPDATE SQL directly)
customers.update(
    where=col("active") == 0,
    set={"active": 1, "updated_at": "2024-01-01"}
)

# Delete rows (executes DELETE SQL directly)
customers.delete(where=col("email").is_null())

Async Support

Moltres also supports async/await for all database operations:

import asyncio
from moltres import async_connect, col

async def main():
    # Connect asynchronously
    db = async_connect("postgresql+asyncpg://user:pass@localhost/db")
    
    # All operations are async
    # For SQL operations, use db.table().select()
    df = db.table("orders").select()
    results = await df.collect()
    
    # Streaming support
    async for chunk in await df.collect(stream=True):
        process_chunk(chunk)
    
    await db.close()

asyncio.run(main())

Note: Async support requires async database drivers. Install with:

  • pip install moltres[async-postgresql] for PostgreSQL (includes async + asyncpg)
  • pip install moltres[async-mysql] for MySQL (includes async + aiomysql)
  • pip install moltres[async-sqlite] for SQLite (includes async + aiosqlite)

💡 Why Moltres?

The Gap in Python's Ecosystem

Python has powerful DataFrame tools (Pandas, Polars) and powerful SQL tools (SQLAlchemy, SQLModel), but no library connects them in a unified, ergonomic way.

The problem: Developers must juggle:

  • Pandas or Polars for DataFrame transformations (but data must be loaded into memory)
  • SQLAlchemy/ORMs for persistence (but not DataFrame-style)
  • Raw SQL for updates/deletes (but not type-safe or composable)

Moltres fixes this by providing:

  • DataFrame API - Transform data with familiar operations (select, filter, join, groupBy)
  • SQL Pushdown Execution - All operations compile to SQL and run on your database—no data loading into memory
  • Real SQL CRUD - INSERT, UPDATE, DELETE with DataFrame-style syntax
  • Works with Existing SQL Infrastructure - No cluster required, works with SQLite, PostgreSQL, MySQL, and more
  • Type Safe - Full type hints for better IDE support and fewer bugs
  • Production Ready - Environment variables, connection pooling, monitoring hooks
  • Secure by Default - SQL injection prevention built-in

Who Needs Moltres?

  • Data Engineers - Avoid loading millions of rows into memory just to update a subset
  • Backend Developers - Replace many ORM operations with cleaner, column-aware DataFrame syntax
  • Analytics Engineers / dbt Users - Express SQL models in Python code with DataFrame chaining
  • Product Engineers - Validated, type-safe CRUD without hand-writing SQL
  • Teams migrating off Spark - Familiar DataFrame API style for traditional SQL databases—no cluster required. Note: Moltres focuses on SQL features, not PySpark feature parity. Features are included only if they map to SQL capabilities.

📖 Core Concepts

Design Philosophy: Moltres provides a DataFrame API that compiles to SQL. We focus on supporting SQL features (standard SQL and common dialect extensions) rather than replicating every PySpark feature. If a feature doesn't map to SQL/SQLAlchemy or doesn't align with SQL pushdown execution, it's not included.

Lazy Evaluation

All DataFrame operations are lazy—they build a logical plan that only executes when you call collect(). The plan is compiled to SQL and executed on your database:

# This doesn't execute any SQL yet
df = db.table("users").select().where(col("age") > 18)

# SQL is compiled and executed here
results = df.collect()

Column Expressions

Build complex expressions using column operations:

from moltres.expressions.functions import sum, avg, count, concat

df = (
    db.table("sales")
    .select(
        col("product"),
        (col("price") * col("quantity")).alias("revenue"),
        concat(col("first_name"), lit(" "), col("last_name")).alias("full_name"),
    )
    .where(col("date") >= "2024-01-01")
    .group_by("product")
    .agg(
        sum(col("revenue")).alias("total_revenue"),
        avg(col("price")).alias("avg_price"),
        count("*").alias("order_count"),
    )
)

📥 Reading Data

From Database Tables

# For SQL operations, use db.table().select()
df = db.table("customers").select()
df = db.table("customers").select("id", "name", "email")

From Files

Moltres supports loading data from various file formats. File readers return Records, not DataFrame - this makes it clear that file data is materialized and not suitable for SQL operations.

# CSV files - returns Records
records = db.load.csv("data.csv")
records = db.load.option("delimiter", "|").csv("pipe_delimited.csv")
records = db.load.option("header", False).schema([...]).csv("no_header.csv")

# JSON files - returns Records
records = db.load.json("data.json")  # Array of objects
records = db.load.jsonl("data.jsonl")  # One JSON object per line

# Parquet files (requires pandas and pyarrow) - returns Records
records = db.load.parquet("data.parquet")

# Text files (one line per row) - returns Records
records = db.load.text("log.txt", column_name="line")

# Generic format reader - returns Records
records = db.load.format("csv").option("header", True).load("data.csv")

# Records can be used directly with insert operations
table.insert(records)  # Records implements Sequence protocol
# Or use the convenience method
records.insert_into("table_name")

# Access data
rows = records.rows()  # Get all rows as a list
for row in records:  # Iterate directly
    process(row)

Schema Inference and Explicit Schemas

Schema is automatically inferred from data, but you can provide explicit schemas:

from moltres.table.schema import ColumnDef

schema = [
    ColumnDef(name="id", type_name="INTEGER"),
    ColumnDef(name="name", type_name="TEXT"),
    ColumnDef(name="score", type_name="REAL"),
]

records = db.load.schema(schema).csv("data.csv")

File Format Options:

  • CSV: header (default: True), delimiter (default: ","), inferSchema (default: True)
  • JSON: multiline (default: False) - if True, reads as JSONL
  • Parquet: Requires pandas and pyarrow

Important: File readers (db.load.*) return Records, not DataFrame. Records are materialized data containers that can be:

  • Iterated directly: for row in records: ...
  • Converted to a list: rows = records.rows()
  • Used with insert operations: table.insert(records) or records.insert_into("table")

For SQL operations (select, filter, join, etc.), use db.table(name).select() to get a DataFrame.

📤 Writing Data

To Database Tables

# Write with automatic schema inference and table creation
df.write.save_as_table("target_table")

# Write modes
df.write.mode("append").save_as_table("target")  # Add to existing (default)
df.write.mode("overwrite").save_as_table("target")  # Replace contents
df.write.mode("error_if_exists").save_as_table("target")  # Fail if exists

# Insert into existing table (table must exist)
df.write.insertInto("existing_table")

# With explicit schema
from moltres.table.schema import ColumnDef
schema = [
    ColumnDef(name="id", type_name="INTEGER"),
    ColumnDef(name="name", type_name="TEXT"),
]
df.write.schema(schema).save_as_table("target")

To Files

# Various formats
df.write.csv("output.csv")
df.write.json("output.json")
df.write.jsonl("output.jsonl")
df.write.parquet("output.parquet")  # Requires pandas and pyarrow

# Generic save
df.write.save("output.csv")  # Infers format from extension
df.write.save("data.txt", format="csv")  # Explicit format

# With options
df.write.option("header", True).option("delimiter", "|").csv("output.csv")
df.write.option("compression", "gzip").parquet("output.parquet")

# Partitioned writes
df.write.partitionBy("country", "year").csv("partitioned_data")

File Formats:

  • CSV: Standard comma-separated values (options: header, delimiter)
  • JSON: Array of objects (options: indent)
  • JSONL: One JSON object per line
  • Parquet: Columnar format (requires pandas and pyarrow, options: compression)

🌊 Streaming for Large Datasets

Moltres supports streaming operations for datasets larger than available memory:

# Enable streaming mode
records = db.load.stream().option("chunk_size", 10000).csv("large_file.csv")

# Process records (streaming Records iterate row-by-row)
for row in records:
    process(row)

# Or materialize all at once
all_rows = records.rows()  # Materializes all data

# Streaming writes
df.write.stream().mode("overwrite").save_as_table("large_table")
df.write.stream().csv("output.csv")

# Streaming SQL queries
df = db.table("large_table").select()
for chunk in df.collect(stream=True):
    process_chunk(chunk)

Streaming Options:

  • .stream(): Enable streaming mode (default: False for backward compatibility)
  • .option("chunk_size", N): Set chunk size for reads (default: 10000)
  • .option("batch_size", N): Set batch size for SQL inserts (default: 10000)
  • collect(stream=True): Return iterator of row chunks instead of materializing

When to Use Streaming:

  • Files or tables larger than available RAM
  • Processing data in batches for memory efficiency
  • Incremental processing pipelines
  • Large data transformations

🗄️ Table Management

Creating Tables

from moltres import column, connect

db = connect("sqlite:///example.db")

# Create a table with schema definition
customers = db.create_table(
    "customers",
    [
        column("id", "INTEGER", nullable=False, primary_key=True),
        column("name", "TEXT", nullable=False),
        column("email", "TEXT", nullable=True),
        column("active", "INTEGER", default=1),
    ],
)

# Insert data
customers.insert([
    {"id": 1, "name": "Alice", "email": "alice@example.com"},
    {"id": 2, "name": "Bob", "email": "bob@example.com"},
])

# Drop tables
db.drop_table("customers")

The column() helper accepts:

  • name: Column name
  • type_name: SQL type (e.g., "INTEGER", "TEXT", "REAL", "VARCHAR(255)")
  • nullable: Whether the column allows NULL (default: True)
  • default: Default value for the column (optional)
  • primary_key: Whether this is a primary key column (default: False)

✏️ Data Mutations

Insert, update, and delete operations run eagerly:

from moltres import col

customers = db.table("customers")

# Insert rows (batch optimized)
customers.insert([
    {"id": 1, "name": "Alice", "active": 1},
    {"id": 2, "name": "Bob", "active": 0},
])

# Update rows
customers.update(where=col("id") == 2, set={"active": 1})

# Delete rows
customers.delete(where=col("active") == 0)

📊 Result Formats

By default, collect() returns a list of dictionaries (fetch_format="records"), so Moltres works even when pandas/polars are unavailable. You can configure the result format when connecting:

# Default: list of dicts
db = connect("sqlite:///example.db")
results = df.collect()  # List[Dict[str, Any]]

# Pandas DataFrame (requires pandas)
db = connect("sqlite:///example.db", fetch_format="pandas")
results = df.collect()  # pandas.DataFrame

# Polars DataFrame (requires polars)
db = connect("sqlite:///example.db", fetch_format="polars")
results = df.collect()  # polars.DataFrame

⚙️ Configuration

Programmatic Configuration

db = connect(
    "postgresql://user:pass@host/dbname",
    echo=True,  # Enable SQL logging
    fetch_format="pandas",
    pool_size=10,
    max_overflow=5,
    pool_timeout=30,
    pool_recycle=3600,
    pool_pre_ping=True,  # Connection health checks
)

Environment Variables

Moltres supports configuration via environment variables for easier deployment (12-factor app friendly):

export MOLTRES_DSN="postgresql://user:pass@host/dbname"
export MOLTRES_POOL_SIZE=10
export MOLTRES_POOL_PRE_PING=true
export MOLTRES_FETCH_FORMAT="pandas"

Then in your code:

from moltres import connect

# Uses MOLTRES_DSN from environment
db = connect()

Supported environment variables:

  • MOLTRES_DSN: Database connection string
  • MOLTRES_ECHO: Enable SQL logging (true/false)
  • MOLTRES_FETCH_FORMAT: "records", "pandas", or "polars"
  • MOLTRES_DIALECT: Override SQL dialect
  • MOLTRES_POOL_SIZE: Connection pool size
  • MOLTRES_MAX_OVERFLOW: Maximum pool overflow
  • MOLTRES_POOL_TIMEOUT: Pool timeout in seconds
  • MOLTRES_POOL_RECYCLE: Connection recycle time
  • MOLTRES_POOL_PRE_PING: Enable connection health checks (true/false)

Configuration Precedence: Programmatic arguments > Environment variables > Defaults

📈 Performance Monitoring

Moltres provides optional performance monitoring hooks for tracking query execution:

from moltres.engine import register_performance_hook

def log_slow_queries(sql: str, elapsed: float, metadata: dict):
    if elapsed > 1.0:
        print(f"Slow query ({elapsed:.2f}s): {sql[:100]}")
        print(f"  Rows affected: {metadata.get('rowcount', 'N/A')}")

register_performance_hook("query_end", log_slow_queries)

# Now all queries will be monitored
db = connect("sqlite:///example.db")
df.collect()  # Slow queries will be logged

# Unregister when done
from moltres.engine import unregister_performance_hook
unregister_performance_hook("query_end", log_slow_queries)

Available Events:

  • query_start: Fired when a query begins execution
  • query_end: Fired when a query completes (includes elapsed time and metadata)

🔒 Security

Moltres includes built-in security features to prevent SQL injection:

  • SQL Identifier Validation - All table and column names are validated
  • Parameterized Queries - All user data is passed as parameters, never string concatenation
  • Input Sanitization - Comprehensive validation of identifiers and inputs

See docs/SECURITY.md for security best practices and guidelines.

📚 Advanced Examples

Complex Joins and Aggregations

from moltres import col
from moltres.expressions.functions import sum, avg, count

# Multi-table join with aggregations
df = (
    db.table("orders")
    .select()
    .join(db.table("customers").select(), on=[("customer_id", "id")])
    .join(db.table("products").select(), on=[("product_id", "id")])
    .where(col("orders.date") >= "2024-01-01")
    .group_by("customers.country", "products.category")
    .agg(
        sum(col("orders.amount")).alias("total_revenue"),
        avg(col("orders.amount")).alias("avg_order_value"),
        count("*").alias("order_count"),
    )
    .order_by(col("total_revenue").desc())
    .limit(10)
)

results = df.collect()

Window Functions

# Complex expressions with window functions
df = (
    db.table("sales")
    .select(
        col("product"),
        col("amount"),
        col("date"),
        (col("amount") - avg(col("amount")).over()).alias("deviation_from_avg"),
    )
    .where(col("date") >= "2024-01-01")
)

Complete ETL Pipeline

# Complete ETL pipeline
db = connect("postgresql://user:pass@localhost/warehouse")

# Extract: Load from CSV (returns Records)
raw_records = db.load.csv("raw_sales.csv")

# Load raw data into staging table
db.create_table("staging_sales", [
    column("order_id", "INTEGER"),
    column("product", "TEXT"),
    column("amount", "REAL"),
    column("date", "DATE"),
])
raw_records.insert_into("staging_sales")

# Transform: Clean and aggregate using SQL operations
cleaned = (
    db.table("staging_sales")
    .select(
        col("order_id"),
        col("product").upper().alias("product"),
        col("amount").cast("REAL"),
        col("date"),
    )
    .where(col("amount") > 0)
    .group_by("product", "date")
    .agg(sum(col("amount")).alias("daily_revenue"))
)

# Load: Write to database
cleaned.write.mode("overwrite").save_as_table("daily_sales_summary")

🛠️ Supported Operations

DataFrame Operations

  • select() - Project columns
  • where() / filter() - Filter rows
  • join() - Join with other DataFrames
  • group_by() / groupBy() - Group rows
  • agg() - Aggregate functions
  • order_by() - Sort rows
  • limit() - Limit number of rows

Column Expressions

  • Arithmetic: +, -, *, /, %
  • Comparisons: ==, !=, <, >, <=, >=
  • Boolean: &, |, ~
  • Functions: sum(), avg(), count(), concat(), coalesce(), upper(), lower(), etc.

Supported SQL Dialects

  • ✅ SQLite
  • ✅ PostgreSQL
  • ✅ MySQL (basic support)
  • ✅ Other SQLAlchemy-supported databases (with ANSI SQL fallback)

🧪 Development

Setup

# Clone the repository
git clone https://github.com/eddiethedean/moltres.git
cd moltres

# Install in development mode
pip install -e ".[dev]"

# Install pre-commit hooks
pre-commit install

Running Tests

# Run all tests
pytest

# Run tests in parallel
pytest -n 9

# Run with coverage
pytest --cov=src/moltres --cov-report=html

Code Quality

# Linting
ruff check .

# Formatting
ruff format .

# Type checking (strict mode enabled)
mypy src

📖 Documentation

Additional documentation is available in the docs/ directory:

🤝 Contributing

Contributions are welcome! Please see CONTRIBUTING.md for guidelines.

Quick Start:

  1. Fork the repository
  2. Create a feature branch (git checkout -b feature/amazing-feature)
  3. Commit your changes (git commit -m 'Add some amazing feature')
  4. Push to the branch (git push origin feature/amazing-feature)
  5. Open a Pull Request

Before submitting:

  • Run tests: pytest
  • Check code quality: ruff check . && mypy src
  • Update documentation if needed

👤 Author

Odos Matthews

🙏 Acknowledgments

  • Inspired by PySpark's DataFrame API style, but focused on SQL feature support rather than PySpark feature parity
  • Built on SQLAlchemy for database connectivity and SQL compilation
  • Thanks to all contributors and users

📄 License

MIT License - see LICENSE file for details.


Made with ❤️ for the Python data community

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BLAKE2b-256 0437cae320dd5b0c6648ad79fee867be0b22822218d78b156bd6bc3d8f302d27

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