Catalogue tag

#scientific-computing

Every repository in the public record carrying this tag — from its GitHub topics or the keywords its package registries publish. Health is measured under the same versioned methodology as the rest of the record.

71 records

Tagged “scientific-computing”Ranked by health index

crates.io

83Excellenthealth index

cpmech/russell

Rust Scientific Library. ODE, DAE, and PDE solvers. Special functions (Bessel, Elliptic, Beta, Gamma, Erf). Linear algebra. Sparse solvers. Probability distributions. Tensor calculus. Numerical continuation.

Rust★ 193↓ 1,817/moSep 14, 2026

MITSep 14, 2026 · metrics 2.10.0

PyPI

83Excellenthealth index

maroba/findiff

Python package for numerical derivatives and partial differential equations in any number of dimensions.

Python★ 509↓ 54.6K/moOct 21, 2026

MITOct 21, 2026 · metrics 2.10.0

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81Excellenthealth index

casadi/casadi

CasADi is a symbolic framework for numeric optimization implementing automatic differentiation in forward and reverse modes on sparse matrix-valued computational graphs. It supports self-contained C-code generation and interfaces state-of-the-art codes such as SUNDIALS, IPOPT etc. It can be used from C++, Python, Matlab/Octave, Julia or Javascript

C++ · SWIG · C★ 2,293Sep 17, 2026

LGPL-3.0Sep 17, 2026 · metrics 2.10.0

npm

81Excellenthealth index

cyanheads/pubchem-mcp-server

Search the PubChem chemical database for compounds, properties, safety data, bioactivity, cross-references, and entity summaries via MCP. STDIO or Streamable HTTP.

TypeScript★ 10↓ 2,124/moOct 20, 2026

Apache-2.0Oct 20, 2026 · metrics 2.10.0

PyPI · npm

81Excellenthealth index

iowarp/clio-kit

Bringing AI practically to science!

Python★ 26↓ 3,845/moSep 9, 2026

BSD-3-ClauseSep 9, 2026 · metrics 2.10.0

80Excellenthealth index

goplus/ixgo

The Go/XGo Interpreter

Go★ 142Sep 18, 2026

Apache-2.0Sep 18, 2026 · metrics 2.10.0

PyPI

80Excellenthealth index

rootcoder007/morie

Multi-domain Open Research and Inferential Estimation

Python · R★ 0Sep 21, 2026

AGPL-3.0Sep 21, 2026 · metrics 2.10.0

Packagist

78Goodhealth index

RubixML/Tensor

A library and extension that provides objects for scientific computing in PHP.

PHP · C · Zephir★ 280↓ 59.7K/moSep 19, 2026

MITSep 19, 2026 · metrics 2.10.0

PyPI

78Goodhealth index

cogent3/scinexus

composable apps for scientific programming

Python★ 7↓ 3,614/moOct 2, 2026

BSD-3-ClauseOct 2, 2026 · metrics 2.10.0

PyPI

78Goodhealth index

sun-data/named-arrays

Python library that implements named tensors with Astropy Quantity support.

Python★ 5↓ 4,356/moOct 18, 2026

BSD-3-ClauseOct 18, 2026 · metrics 2.10.0

crates.io

77Goodhealth index

Axect/Peroxide

Rust numeric library with high performance and friendly syntax

Rust★ 731↓ 111.4K/moOct 20, 2026

Apache-2.0Oct 20, 2026 · metrics 2.10.0

PyPI · crates.io

77Goodhealth index

SpM-lab/sparse-ir-rs

Rust implementation of intermediate representation (IR) for imaginary-time propagators

Rust · C++ · Fortran★ 7↓ 1,781/moOct 19, 2026

MITOct 19, 2026 · metrics 2.10.0

PyPI

77Goodhealth index

bioio-devs/bioio-lif

A BioIO reader plugin for reading LIF (Leica Image File) images.

Python★ 1↓ 9,781/moOct 14, 2026

BSD-3-ClauseOct 14, 2026 · metrics 2.10.0

PyPI · npm

75Goodhealth index

iowarp/clio-agent

A science agent supporting any general AI agent in performing data management operations at scale. Builds upon the heritage of the IOWarp platform and proudly represents work done at Gnosis Research Center at Illinois Tech. Supported by NSF.

Python · HTML★ 10↓ 9,606/moOct 21, 2026

Custom licenseOct 21, 2026 · metrics 2.10.0

crates.io

75Goodhealth index

rust-ndarray/ndarray

ndarray: an N-dimensional array with array views, multidimensional slicing, and efficient operations

Rust★ 4,321↓ 9M/moSep 17, 2026

Apache-2.0Sep 17, 2026 · metrics 2.10.0

PyPI

73Goodhealth index

deepcharles/ruptures

ruptures: change point detection in Python

Python★ 2,083↓ 1.5M/moSep 17, 2026

BSD-2-ClauseSep 17, 2026 · metrics 2.10.0

PyPI

71Goodhealth index

elkins-lab/synth-pdb

Generate realistic PDB files with mixed secondary structures for testing, education and bioinformatics tool development. Jupyter Notebook tutorials are available to visualize the concepts..

Python★ 2Sep 9, 2026

MITSep 9, 2026 · metrics 2.10.0

PyPI

71Goodhealth index

sun-data/regridding

Numba-accelerated interpolation of NumPy n-dimensional arrays.

Python · Jupyter Notebook★ 2↓ 4,505/moOct 19, 2026

BSD-3-ClauseOct 19, 2026 · metrics 2.10.0

PyPI · npm

69Goodhealth index

Furox-Art/scientific-computing-system-2.0

Scientific computing platform on NumPy/SciPy/pandas/matplotlib: linear algebra, stats, optimization, signals, ML, information theory, chaos, Bayes, metaheuristics, geometry and RL.

Python★ 1↓ 5,867/moSep 29, 2026

MITSep 29, 2026 · metrics 2.10.0

PyPI · crates.io

69Goodhealth index

VolkovIlia/semiflow

Fast no_std Rust library for evolution equations and PDEs via Chernoff approximation of operator semigroups — heat, Schrödinger, diffusion, graph & manifold operators. Bindings for C, Python, and WebAssembly.

Rust · Python★ 3↓ 698/moSep 6, 2026

Apache-2.0Sep 6, 2026 · metrics 2.10.0

PyPI

69Goodhealth index

elkins-lab/diff-biophys

Differentiable biophysical modeling in JAX (SAXS, NMR, CD), with Jupyter Notebook examples.

Python★ 0↓ 30/moSep 9, 2026

MITSep 9, 2026 · metrics 2.10.0

crates.io

67Goodhealth index

Entrolution/echidna

A high-performance automatic differentiation library for Rust

Rust★ 8↓ 2,728/moOct 20, 2026

Apache-2.0Oct 20, 2026 · metrics 2.10.0

PyPI

67Goodhealth index

jessegrabowski/better_optimize

A friendlier front-end to scipy.optimize

Python★ 7↓ 135.9K/moOct 18, 2026

MITOct 18, 2026 · metrics 2.10.0

PyPI

67Goodhealth index

simpeg/pymatsolver

Solve matrix equations in python.

Python★ 43↓ 15.9K/moOct 16, 2026

MITOct 16, 2026 · metrics 2.10.0

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65Goodhealth index

arrayfire/arrayfire

ArrayFire: a general purpose GPU library.

C++★ 4,903Oct 18, 2026

BSD-3-ClauseOct 18, 2026 · metrics 2.10.0

65Goodhealth index

scttfrdmn/globus-go-cli

Fast, modern Go CLI for Globus services (Auth, Transfer) - aligned with upstream v3.37.0. Alternative to Python CLI with native performance, multiple output formats, and comprehensive service coverage.

Go★ 0Sep 18, 2026

Custom licenseSep 18, 2026 · metrics 2.10.0

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62Moderatehealth index