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Optimization of Classical Molecular Dynamics

CoMD is an open-source classical molecular dynamics code. One of its prime application areas is materials modeling.

Criado por Andrey Vladimirov Última atualização em 12/12/2018 - 18:00

Books - High Performance Parallelism Pearls

A look into the contents of the two "Pearls" books, edited by James Reinders and Jim Jeffers. These books contain a collection of examples of code modernization.
Criado por Mike P. (Intel) Última atualização em 30/09/2019 - 17:30

Parallel Programming Books

Use these parallel programming resources and books with your Intel® Xeon® processor and Intel® Xeon Phi™ processor family
Criado por Mike P. (Intel) Última atualização em 30/09/2019 - 17:28

Free access to Intel® Compilers, Performance libraries, Analysis tools and more...

Intel® Parallel Studio XE is a very popular product from Intel that includes the Intel® Compilers, Intel® Performance Libraries, tools for analysis, debugging and tuning, tools for MPI and the Intel® MPI Library. Did you know that some of these are available for free? Here is a guide to “what is available free” from the Intel Parallel Studio XE suites.
Criado por administrar Última atualização em 30/09/2019 - 17:28

Classical Molecular Dynamics Simulations with LAMMPS Optimized for Knights Landing

LAMMPS is an open-source software package that simulates classical molecular dynamics. As it supports many energy models and simulation options, its versatility has made it a popular choice. It was first developed at Sandia National Laboratories to use large-scale parallel computation.
Criado por WILLIAM B. (Intel) Última atualização em 15/10/2019 - 15:10

Analyzing GTC-P APEX code using Intel® Advisor on an Intel® Xeon Phi™ processor

Criado por Munara T. (Intel) Última atualização em 15/10/2019 - 15:30

Process and Thread Affinity for Intel® Xeon Phi™ Processors

The Intel® MPI Library and OpenMP* runtime libraries can create affinities between processes or threads, and hardware resources. This affinity keeps an MPI process or OpenMP thread from migrating to a different hardware resource, which can have a dramatic effect on the execution speed of a program.
Criado por Gregg S. (Intel) Última atualização em 15/10/2019 - 15:30

What is Code Modernization?

Modern high performance computers are built with a combination of resources including:

Criado por Mike P. (Intel) Última atualização em 15/10/2019 - 15:30

Hybrid Parallelism: Parallel Distributed Memory and Shared Memory Computing

There are two principal methods of parallel computing: distributed memory computing and shared memory computing. As more processor cores are dedicated to large clusters solving scientific and engineering problems, hybrid programming techniques combining the best of distributed and shared memory programs are becoming more popular.
Criado por David M. Última atualização em 15/10/2019 - 16:40

Hybrid Parallelism: A MiniFE* Case Study

This case study examines the situation where the problem decomposition is the same for threading as it is for Message Passing Interface* (MPI); that is, the threading parallelism is elevated to the same level as MPI parallelism.
Criado por David M. Última atualização em 15/10/2019 - 16:40