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A CUDA implementation of the transpose-free Quasi-Minimal Residual method

Protein Folding and Aggregation Simulator

Simulation module

Benchmark of kernels in ChASE and others

A minimalistic I/O forwarding server and client library for SIONlib.

A plugin for ProFASi version 2.1 enabling simulations of protein systems in presence of hard sphere "crowders".

A UnrealEngine-Wrapper for the yaml-cpp Library

Course material for the course "Programming in C++", 9 --13 May 2022, organized by the Jülich Supercomputing Centre, Forschungszentrum Jülich, Germany.

High-level Fortran and C wrappers for D.E.Shaw Research's random123

A repo for Monte Carlo calculations for carbon nanostructures.