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SMILES to mol2 converter based on OpenBabel (https://github.com/openbabel/openbabel)

This repository contains directive approach to GPU programming using OpenMP and OpenACC. This is the series of lectures on the GPU programming that CINECA is organising in the framework of Prace school.

Minimal reimplementation of openFOAM for testing data structures and GPU porting strategies

repo for material to be used during the school https://events.prace-ri.eu/event/929/

Hands_On session for PRACE HPB2020

All the numeric kernels needed to run yoctoFOAM on a GPU using OpenACC

This course illustrates the key features of C language, with emphasis to modern programming style for scientific and technical applications particularly suitable to HPC environments. After a brief introduction on the C fundamentals we will discuss its flaws and strengths and the conceptual guidelines that allowed C to be one of the most widespread, efficient and general purpose languages even decades after its birth. We will show common idioms and best practices focusing on scientific and technical use cases.

Course for the parallel training school given by Cineca for Polimi. Organized by M. Cremonesi

This is an empty repository to be used as source URL in spack packages without remote sources

A couple of test and results for the new PW.X based on cudafortran.

Post processing utilities to analyze vtk output files from LIGGGHTS

This repo contains info, scripts, templates and tentative documentation for multiplatform ( Linux, Windows, OSX) useful for test client-side setup of new security POC implementing two factor authentication and bastion host access

Common interfaces for the yoctoFOAM project

Scripts for creating the input files for yoctoFOAM