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Tags: Science and math
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217–240 of 270 · Most stars

A powerful library extending VBA with over 100 functions for math, stats, finance, and data manipulation. It supports matrix operations, and user-defined functions, enhancing automation and analysis within Microsoft Office and LibreOffice environments for data management, financial calculations, an more.

  • equation-systems
  • mathematical-expression-parser
  • mathematical-expressions-evaluator
  • determinant-calculation

Multi-stage Riemannian flow matching for physically valid molecular docking, with GNINA scoring, PoseBusters filtering, CLI inference, and benchmarks.

  • alphafold3
  • docking
  • drug-design
  • drug-discovery

NASA/JPL SPICE Toolkit for C – patched for cross-platform compatibility

  • astronomy
  • astronomical-algorithms
  • celestial-mechanics
  • nasa

A weather server supporting Campbell Scientific and Davis Instruments stations with lots of data-sharing options

A implementation of Shor's algorithm written in Python calling Q# for the quantum part

  • qsharp
  • python3

Java Scientific Computing Library - Signal Processing, FFT, Filters, PSD, DCT, SciPy-like APIs for JVM & Android used in Machine Learning and Data Science.

PyTorch implementation of "TGSA: Protein-Protein Association-Based Twin Graph Neural Networks for Drug Response Prediction with Similarity Augmentation"

ODE system solver made simple. For IVPs (initial value problems).

  • runge-kutta-fehlberg
  • runge-kutta
  • simulation
  • ode-solver

Computer Algebra for microcontrollers using https://github.com/micropython/micropython