The Chemistry Development Kit
- code4lib
- chemistry
- java
- cheminformatics
47,133 repositories indexed
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The Chemistry Development Kit
A pure Go 3D math library.
🎯 A comprehensive gradient-free optimization framework written in Python
A unit handling library for ruby
A library provides spatial data and geometric algorithms
C library for reading virtual slide images
A blazing fast matrix library for Elixir/Erlang with C implementation using CBLAS.
Python version of the SGP4 satellite position library
Dense and sparse linear algebra library for Ruby via SciRuby
Advanced date, time and interval library for Java with sun/moon-astronomy and calendars like Chinese, Coptic, Ethiopian, French Republican, Hebrew, Hijri, Historic Christian, Indian National, Japanese, Julian, Korean, Minguo, Persian, Thai, Vietnamese
Ruby/Numo::NArray - New NArray class library
A C++14-compatible physical units library with no dependencies and a single-file delivery option. Emphasis on safety, accessibility, performance, and developer experience.
C Implementation of 1D and 2D Wavelet Transforms (DWT,SWT and MODWT) along with 1D Wavelet packet Transform and 1D Continuous Wavelet Transform.
A thin layer of graphic data types
The fastest automatic differentiation library for C++, with Python bindings. Forward, adjoint and higher-order derivatives, checkpointing, Eigen support and JIT. Reproducible benchmarks against CppAD, Adept and autodiff.
Benchmarking analysis of data integration tools
Parsers and algorithms for computational chemistry logfiles
PyKEP is a scientific library providing basic tools for research in interplanetary trajectory design.
Multibody dynamics tool kit.
A simple script for fracturing polygons. Also adds nice helper functions for polygons like calculateArea, triangulate, getRandomPointsInPolygon, getBoundingRect)
V library to develop Artificial Intelligence and High-Performance Scientific Computations
The fast Continuous Wavelet Transform (fCWT) is a library for fast calculation of CWT.
Python library for multilinear algebra and tensor factorizations
Quantum Computer Library for Everyone