SciPy library main repository
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Jan 4, 2026 - Python
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scientific-computing
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A flexible package manager that supports multiple versions, configurations, platforms, and compilers.
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Jan 4, 2026 - Python
A set of ready to use scientific skills for Claude
bioinformatics genomics computational-biology scientific-visualization scientific-computing drug-discovery data-analysis proteomics metabolomics chemoinformatics materials-science clinical-research claude ai-scientist claudecode claude-skills
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Jan 4, 2026 - Python
Sequential model-based optimization with a `scipy.optimize` interface
visualization machine-learning binder optimization scikit-learn scientific-visualization scientific-computing hyperparameter-optimization bayesopt bayesian-optimization hacktoberfest hyperparameter-tuning hyperparameter hyperparameter-search sequential-recommendation
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Feb 23, 2024 - Python
CUDA integration for Python, plus shiny features
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Dec 1, 2025 - Python
ruptures: change point detection in Python
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Nov 27, 2025 - Python
😎 Curated list of awesome software for numerical analysis and scientific computing
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Jan 1, 2026 - Python
Eliot: the logging system that tells you *why* it happened
python elasticsearch numpy logging twisted tracing scientific-computing asyncio logging-library journald dask causality causation causality-analysis
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Feb 28, 2025 - Python
OpenCL integration for Python, plus shiny features
python sorting performance opengl amd gpu opencl array parallel-computing cuda reduction nvidia scientific-computing prefix-sum heterogeneous-parallel-programming parallel-algorithm shared-memory multidimensional-arrays pyopencl
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Dec 28, 2025 - Python
PDEBench: An Extensive Benchmark for Scientific Machine Learning
benchmark machine-learning ai deep-learning simulation pytorch scientific-computing neural-networks scientific partial-differential-equations fluid-dynamics jax navier-stokes-equations sciml autoregressive-models physics-informed-neural-networks neural-operators
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May 15, 2025 - Python
poliastro - 🚀 Astrodynamics in Python
python science space astrodynamics scientific-computing orbital-simulation space-physics hacktoberfest orbital-mechanics celestial-mechanics closember
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Oct 14, 2023 - Python
[CONTRIBUTORS WELCOME] Generalized Additive Models in Python
python data-science machine-learning scientific-computing hacktoberfest gams interpretable-ai interpretable-ml explainable-ai explainable-ml interpretable-machine-learning
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Dec 29, 2025 - Python
Knee point detection in Python 📈
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Oct 6, 2025 - Python
A library for solving differential equations using neural networks based on PyTorch, used by multiple research groups around the world, including at Harvard IACS.
deep-learning time-series pypi pytorch artificial-intelligence ode scientific-computing neural-networks differential-equations mathematical-modelling odes pinn pde-solver initial-value-problem boundary-value-problem physics-informed-neural-networks
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Jul 27, 2025 - Python
Video Processing in Python
python video video-processing scientific-computing ffmpeg-wrapper quality-assessment scene-detection
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Jul 4, 2025 - Python
Protein-Ligand Interaction Profiler - Analyze and visualize non-covalent protein-ligand interactions in PDB files according to 📝 Schake, Bolz, et al. (2025), https://doi.org/10.1093/nar/gkaf361
docker bioinformatics pdb protein-structure singularity python-bindings scientific-computing openbabel plip
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Oct 30, 2025 - Python
A code generator for array-based code on CPUs and GPUs
python performance code-generator opencl array cuda scan reduction scientific-computing prefix-sum code-generation performance-analysis multidimensional-arrays code-optimization code-transformation loop-optimization ispc
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Dec 26, 2025 - Python
An elegant Python interface for visualization on the web platform to interactively generate insights into multidimensional images, point sets, and geometry.
python open-source jupyter reproducible-research point-cloud open-science scientific-visualization scientific-computing image-analysis itk imaging meshes insight-toolkit jupyter-widget kitware medical-visualization jupyterlab-extension
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Mar 13, 2025 - Python
Simulation and Parameter Estimation in Geophysics - A python package for simulation and gradient based parameter estimation in the context of geophysical applications.
python simulation optimization modeling linear-algebra inversion geoscience geophysics open-science scientific-computing partial-differential-equations modelling finite-volume multiphysics electromagnetics magnetotellurics direct-current-resistivity induced-polarization richards-equation inverse-problems
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Dec 9, 2025 - Python
Framework of fast implementation data processing and operating pipelines
machine-learning neural-network pipeline-framework data-visualization transformer scientific-computing mathematical-statistics
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Sep 6, 2025 - Python
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