Lightweight locality-aware user-level threading runtime.

config manager based on Git

⚡ TensorFlowASR: Almost State-of-the-art Automatic Speech Recognition in Tensorflow 2. Supported languages that can use characters or subwords

Wrapper interface for MPI

🐸STT - The deep learning toolkit for Speech-to-Text. Training and deploying STT models has never been so easy.

🐸💬 - a deep learning toolkit for Text-to-Speech, battle-tested in research and production

Information about many aspects of high-performance computing. Wiki content moved to ~/docs.

Public proposals, extensions, information and materials from the SYCL working group

A streamlined CMake build system foundation for developing HPC software

Vector class library, latest version

Reference implementation of mdspan targeting C++23

Implementation of SYCL and C++ standard parallelism for CPUs and GPUs from all vendors: The independent, community-driven compiler for C++-based heterogeneous programming models. Lets applications …

A flexible package manager that supports multiple versions, configurations, platforms, and compilers.

Benchmark Suite for Heterogenuous FFT Implementations

LLVM Optimization to extract a function, embedded in its intermediate representation in the binary, and execute it using the LLVM Just-In-Time compiler.

Library to parse and work with the C++ AST

Jupyter widget to interactively view molecular structures and trajectories

Repository of the MPI storage windows extension library.

Data and scripts relevant to an evaluation of force field methods for conformer scoring

Python script that creates 2D protein-ligand interaction images

An open-source C++ library developed and used at Facebook.

A primer on software development best practices for computational chemistry

Benchmark sets for binding free energy calculations: Perpetual review paper, discussion, datasets, and standards

Python implementation of the multistate Bennett acceptance ratio (MBAR)

Public/backup repository of the gromacs molecular simulation toolkit

Public/backup repository of the GROMACS molecular simulation toolkit. Please do not mine the metadata blindly; we use https://gitlab.com/gromacs/gromacs for code review and issue tracking.