Open Source Python Scientific/Engineering Software - Page 3

Python Scientific/Engineering Software

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Browse free open source Python Scientific/Engineering Software and projects below. Use the toggles on the left to filter open source Python Scientific/Engineering Software by OS, license, language, programming language, and project status.

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  • 1

    Presage

    the intelligent predictive text entry platform

    Presage (formerly Soothsayer) is an intelligent predictive text entry system. Presage generates predictions by modelling natural language as a combination of redundant information sources. Presage computes probabilities for words which are most likely to be entered next by merging predictions generated by the different predictive algorithms. Presage's modular and extensible architecture allows its language model to be extended and customized to utilize statistical, syntactic, and semantic predictive algorithms. Presage's predictive capabilities are implemented by predictive plugins. Predictive plugins use services provided by the platform to implement multiple prediction techniques.
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    Downloads: 190 This Week
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  • 2
    Open Drug Discovery Toolkit (ODDT)

    Open Drug Discovery Toolkit (ODDT)

    Modular and comprehensive toolkit for use in cheminformatics

    Open Drug Discovery Toolkit (ODDT) is modular and comprehensive toolkit for use in cheminformatics, molecular modeling etc. ODDT is written in Python, and makes extensive use of Numpy/Scipy. You can use any supported toolkit united under common API (for reference see Pybel or Cinfony). All methods and software based on Pybel/Cinfony should be drop-in compatible with ODDT toolkits. In contrast to its predecessors, which were aimed to have minimalistic API, ODDT introduces extended methods and additional handles. These extensions allow to use of toolkits at all its grace and some features may be backported from others to introduce missing functionalities. Most important and handy property of Molecule in ODDT are Numpy dictionaries containing most properties of supplied molecule. Some of them are straightforward, other require some calculation, ie. atom features. Dictionaries are provided for major entities of molecules.
    Downloads: 12 This Week
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  • 3
    TexGen
    TexGen is a geometric textile modelling software package to be used for obtaining engineering properties of woven textiles and textile composites. Citing TexGen We would be grateful if you could acknowledge use of TexGen where appropriate and suggest using one of the following references: L P Brown and A C Long. "Modelling the geometry of textile reinforcements for composites: TexGen", Chapter 8 in "Composite reinforcements for optimum performance (Second Edition)", ed. P Boisse, Woodhead Publishing Ltd, 2021, ISBN: 978-0-12-819005-0. https://doi.org/10.1016/B978-0-12-819005-0.00008-3 Lin, H., Brown, L. P. & Long, A. C. 2011. Modelling and Simulating Textile Structures using TexGen. Advanced Materials Research, 331, 44-47. To reference version 3.13.0 please use: Louise Brown, mike-matveev, & georgespackman. (2023). louisepb/TexGen: TexGen v3.13.1 (v3.13.1). Zenodo. https://doi.org/10.5281/zenodo.8221491
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    Downloads: 110 This Week
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  • 4
    Brax

    Brax

    Massively parallel rigidbody physics simulation

    Brax is a fast and fully differentiable physics engine for large-scale rigid body simulations, built on JAX. It is designed for research in reinforcement learning and robotics, enabling efficient simulations and gradient-based optimization.
    Downloads: 11 This Week
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  • 5
    Claude Scientific Skills

    Claude Scientific Skills

    A set of ready to use Agent Skills for research, science, engineering

    Claude Scientific Skills is a large open source collection of ready-to-use scientific capabilities that extend AI coding agents into full research assistants. The project provides more than 170 curated skills covering domains such as genomics, drug discovery, medical imaging, physics, and advanced data analysis. Each skill bundles documentation, examples, and tool integrations so agents can reliably execute complex multi-step scientific workflows. The framework follows the open Agent Skills standard and works with multiple AI development environments including Claude Code, Cursor, and Codex. Its primary goal is to reduce the friction of scientific computing by giving AI agents structured access to specialized libraries, databases, and research pipelines. Overall, the repository acts as a modular capability layer that transforms general AI agents into domain-aware computational scientists.
    Downloads: 11 This Week
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  • 6
    Earth Enterprise

    Earth Enterprise

    Google Earth Enterprise - Open Source

    Earth Enterprise is the open source version of Google Earth Enterprise (GEE), a powerful geospatial application suite that enables organizations to build and host custom 3D globes and 2D maps using their own imagery and data. Unlike Google Maps or Google Earth, Earth Enterprise does not include Google’s proprietary imagery but instead provides the tools needed to manage and visualize private geospatial datasets. The system is composed of three main components: Fusion, which processes and integrates imagery, vector, and terrain data into unified map layers; Server, which hosts the resulting globes or maps via Apache or Tornado-based web servers; and Client, which includes the Google Earth Enterprise Client (EC) for 3D visualization and the Google Maps JavaScript API V3 for 2D viewing. Designed for enterprise, research, and government use, it allows for secure, scalable deployment of geospatial visualization systems within private infrastructure.
    Downloads: 11 This Week
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  • 7
    Seeker

    Seeker

    Accurately Locate Smartphones using Social Engineering

    Seeker is an open source project that demonstrates how to obtain precise location information from devices using social engineering and web-based techniques. The tool sets up a phishing page that asks for location permissions, allowing GPS and other device data to be shared if the user consents. It can capture latitude, longitude, accuracy, altitude, direction, and even speed, with results displayed in a terminal. The project supports both manual deployment and tunneling services like Ngrok for external access. While primarily intended as an educational resource on security awareness, it highlights the risks of exposing geolocation data online. Its simplicity and effectiveness have made it a popular project in cybersecurity learning circles.
    Downloads: 11 This Week
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  • 8
    Minsky

    Minsky

    System dynamics program with additional features for economics

    Minsky brings system dynamics and monetary modelling to economics. Models are defined using flowcharts on a drawing canvas (as are Matlab's Simulink, Vensim, Stella, etc). Minsky's unique feature is the "Godley Table", which uses double entry bookkeeping to generate stock-flow consistent models of financial flows. Minsky is good for demonstrating mathematics too, with the most "math-like" interface in system dynamics. Sign up to Minsky's Patreon page (for as little as $1 a month) at https://www.patreon.com/Ravelation/. This creates a user community, which SourceForge doesn't facilitate.
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    Downloads: 59 This Week
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  • 9
    Qiskit

    Qiskit

    Qiskit is an open-source SDK for working with quantum computers

    Qiskit [kiss-kit] is an open-source SDK for working with quantum computers at the level of pulses, circuits, and application modules. When you are looking to start Qiskit, you have two options. You can start Qiskit locally, which is much more secure and private, or you get started with Jupyter Notebooks hosted in IBM Quantum Lab. Qiskit includes a comprehensive set of quantum gates and a variety of pre-built circuits so users at all levels can use Qiskit for research and application development. The transpiler translates Qiskit code into an optimized circuit using a backend’s native gate set, allowing users to program for any quantum processor or processor architecture with minimal inputs. Users can run and schedule jobs on real quantum processors, and employ Qiskit Runtime to orchestrate quantum programs on cloud-based CPUs, QPUs, and GPUs.
    Downloads: 9 This Week
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  • 10
    HEALPix

    HEALPix

    Data Analysis, Simulations and Visualization on the Sphere

    Software for pixelization, hierarchical indexation, synthesis, analysis, and visualization of data on the sphere. Please acknowledge HEALPix by quoting the web page http://healpix.sourceforge.net (or https://healpix.sourceforge.io) and publication: K.M. Gorski et al., 2005, Ap.J., 622, p.759 Full software documentation available at https://healpix.sourceforge.io/documentation.php Wiki Pages: https://sourceforge.net/p/healpix/wiki/Home Exchanging Data with HEALPix (in FITS files): https://sourceforge.net/p/healpix/wiki/Exchanging%20Data%20with%20HEALPix/ GDL and FL users should read https://sourceforge.net/p/healpix/wiki/HEALPix%20and%20GDL/
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    Downloads: 227 This Week
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  • 11
    GenX

    GenX

    X-Ray and Neutron Reflectivity Modeling

    GenX is a scientific program to refine x-ray refelcetivity, neutron reflectivity and surface x-ray diffraction data using the differential evolution algorithm. GenX is very modular and highly extensible and can be used as a general fitting program.
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    Downloads: 122 This Week
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  • 12
    Astropy

    Astropy

    Repository for the Astropy core package

    The Astropy Project is a community effort to develop a common core package for Astronomy in Python and foster an ecosystem of interoperable astronomy packages. Astropy is a Python library for use in astronomy. Learn Astropy provides a portal to all of the Astropy educational material through a single dynamically searchable web page. It allows you to filter tutorials by keywords, search for filters, and make search queries in tutorials and documentation simultaneously. The Anaconda Python Distribution includes Astropy and is the recommended way to install both Python and the Astropy package. The astropy package contains key functionality and common tools needed for performing astronomy and astrophysics with Python. It is at the core of the Astropy Project, which aims to enable the community to develop a robust ecosystem of affiliated packages covering a broad range of needs for astronomical research, data processing, and data analysis.
    Downloads: 8 This Week
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  • 13
    Cirq

    Cirq

    A python framework for creating, editing, and invoking NISQ

    Cirq is a Python library for writing, manipulating, and optimizing quantum circuits and running them against quantum computers and simulators.
    Downloads: 8 This Week
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  • 14
    ROMM

    ROMM

    A beautiful, powerful, self-hosted rom manager and player

    ROMM is an Android productivity launcher replacement that focuses on giving users faster, easier access to apps, contacts, and information through intuitive gestures, smart search, and contextual suggestions. It reimagines the home screen with adaptive layouts, predictive app recommendations, and dynamic organization so that frequently used tools are always within reach. The launcher includes a powerful universal search that combs through installed apps, contacts, messages, and web results to deliver quick answers without switching contexts. Romm also supports widgets, customization options, and theme choices so users can tailor the visual experience to their preferences while maintaining performance and responsiveness. Privacy is a highlight, with local indexing and search functions that operate without sending data to external servers unless explicitly permitted.
    Downloads: 8 This Week
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  • 15
    alphageometry

    alphageometry

    AI-driven neuro-symbolic solver for high-school geometry problems

    AlphaGeometry, developed by Google DeepMind, is a theorem-proving system that combines symbolic reasoning with deep learning to solve challenging geometry problems, such as those found in mathematical Olympiads. The repository provides the full implementation of DDAR (Deductive Difference and Abductive Reasoning) and AlphaGeometry, two automated geometry solvers described in the 2024 Nature paper “Solving Olympiad Geometry without Human Demonstrations.” AlphaGeometry integrates a symbolic deduction engine with a transformer-based language model to propose and validate geometric constructions in a stepwise proof process. The DDAR solver focuses purely on rule-based reasoning, while AlphaGeometry enhances this by using a learned model to suggest auxiliary constructions when logical reasoning alone is insufficient. The repository includes pre-trained weights, vocabulary files, and detailed configuration options for reproducing experiments.
    Downloads: 8 This Week
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  • 16
    qaqarot

    qaqarot

    Quantum Computer Library for Everyone

    The Blueqat project has been renamed the Qaqarot Project because of the branding strategy of blueqat inc.
    Downloads: 8 This Week
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  • 17
    whiteboxgui

    whiteboxgui

    An interactive GUI for WhiteboxTools in a Jupyter-based environment

    The whiteboxgui Python package is a Jupyter frontend for WhiteboxTools, an advanced geospatial data analysis platform developed by Prof. John Lindsay (webpage; jblindsay) at the University of Guelph's Geomorphometry and Hydrogeomatics Research Group. WhiteboxTools can be used to perform common geographical information systems (GIS) analysis operations, such as cost-distance analysis, distance buffering, and raster reclassification. Remote sensing and image processing tasks include image enhancement (e.g. panchromatic sharpening, contrast adjustments), image mosaicing, numerous filtering operations, simple classification (k-means), and common image transformations. WhiteboxTools also contains advanced tooling for spatial hydrological analysis (e.g. flow-accumulation, watershed delineation, stream network analysis, sink removal), terrain analysis (e.g. common terrain indices such as slope, curvatures, wetness index, hillshading; hypsometric analysis; etc.
    Downloads: 8 This Week
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  • 18
    Seamly2D

    Seamly2D

    Free and open source pattern design software

    Seamly2D enables the design, reuse, and remix of digital sewing patterns for creating bespoke-fit, specialty-sized, and ready-to-wear-sized clothing. Users have the right to utilize, sell, share, and distribute their patterns in any way they choose. * Downloads: https://seamly.io * Support: https://forum.seamly.io * Code: https://github.com/fashionfreedom/seamly2d * License: GPLv3+
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    Downloads: 203 This Week
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  • 19
    ModbusPal - a Java MODBUS simulator
    ModbusPal is a project to develop a PC-based Modbus simulator. Its goal is to reproduce a realistic environment, with many slaves and animated register values. Almost everything in ModbusPal can be customized and controlled by scripts.
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    Downloads: 87 This Week
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  • 20
    BQSKit

    BQSKit

    Berkeley Quantum Synthesis Toolkit

    The Berkeley Quantum Synthesis Toolkit (BQSKit) [bis • kit] is a powerful and portable quantum compiler framework. It can be used with ease to compile quantum programs to efficient physical circuits for any QPU. A standard workflow utilizing BQSKit consists of loading a program into the framework, modeling the target QPU, compiling the program, and exporting the resulting circuit.
    Downloads: 7 This Week
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  • 21
    Cookiecutter Data Science

    Cookiecutter Data Science

    Project structure for doing and sharing data science work

    A logical, reasonably standardized, but flexible project structure for doing and sharing data science work. When we think about data analysis, we often think just about the resulting reports, insights, or visualizations. While these end products are generally the main event, it's easy to focus on making the products look nice and ignore the quality of the code that generates them. Because these end products are created programmatically, code quality is still important! And we're not talking about bikeshedding the indentation aesthetics or pedantic formatting standards, ultimately, data science code quality is about correctness and reproducibility. It's no secret that good analyses are often the result of very scattershot and serendipitous explorations. Tentative experiments and rapidly testing approaches that might not work out are all part of the process for getting to the good stuff, and there is no magic bullet to turn data exploration into a simple, linear progression.
    Downloads: 7 This Week
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  • 22
    FairChem

    FairChem

    FAIR Chemistry's library of machine learning methods for chemistry

    FAIRChem is a unified library for machine learning in chemistry and materials, consolidating data, pretrained models, demos, and application code into a single, versioned toolkit. Version 2 modernizes the stack with a cleaner core package and breaking changes relative to V1, focusing on simpler installs and a stable API surface for production and research. The centerpiece models (e.g., UMA variants) plug directly into the ASE ecosystem via a FAIRChem calculator, so users can run relaxations, molecular dynamics, spin-state energetics, and surface catalysis workflows with the same pretrained network by switching a task flag. Tasks span heterogeneous domains—catalysis (OC20-style), inorganic materials (OMat), molecules (OMol), MOFs (ODAC), and molecular crystals (OMC)—allowing one model family to serve many simulations. The README provides quick paths for pulling models (e.g., via Hugging Face access), then running energy/force predictions on GPU or CPU.
    Downloads: 7 This Week
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  • 23
    Mathematics Dataset

    Mathematics Dataset

    This dataset code generates mathematical question and answer pairs

    The Mathematics Dataset, developed by Google DeepMind, is a synthetic dataset designed to evaluate and train machine learning models on mathematical reasoning and symbolic manipulation. It generates question-and-answer pairs across a wide range of mathematical topics typically found in school-level curricula, testing a model’s ability to reason about algebra, arithmetic, calculus, probability, and more. Each question is programmatically generated with structured templates to ensure clear logic and reproducibility. The dataset enables models to learn mathematical problem-solving through examples that involve both numeric and symbolic reasoning. Version 1.0 includes over 2 million examples per category, with training splits labeled as “easy,” “medium,” and “hard,” supporting curriculum-based learning strategies. The data can be accessed via PyPI or generated locally using provided Python scripts, with outputs formatted for direct use in training or evaluation pipelines.
    Downloads: 7 This Week
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  • 24
    OpenFermion

    OpenFermion

    The electronic structure package for quantum computers

    OpenFermion is an open source library for compiling and analyzing quantum algorithms to simulate fermionic systems, including quantum chemistry. Among other functionalities, this version features data structures and tools for obtaining and manipulating representations of fermionic and qubit Hamiltonians. For more information, see our release paper. Currently, OpenFermion is tested on Mac, Windows, and Linux. We recommend using Mac or Linux because the electronic structure plugins are only compatible on these platforms. However, for those who would like to use Windows, or for anyone having other difficulties with installing OpenFermion or its plugins, we have provided a Docker image and usage instructions in the docker folder. The Docker image provides a virtual environment with OpenFermion and select plugins pre-installed. The Docker installation should run on any operating system.
    Downloads: 7 This Week
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  • 25
    PyTensor

    PyTensor

    Python library for defining and optimizing mathematical expressions

    PyTensor is a fork of Aesara, a Python library for defining, optimizing, and efficiently evaluating mathematical expressions involving multi-dimensional arrays. PyTensor is based on Theano, which has been powering large-scale computationally intensive scientific investigations since 2007. A hackable, pure-Python codebase. Extensible graph framework is suitable for rapid development of custom operators and symbolic optimizations. Implements an extensible graph transpilation framework that currently provides compilation via C, JAX, and Numba. Based on one of the most widely-used Python tensor libraries: Theano.
    Downloads: 7 This Week
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