Scalabe Molecular Simulations Using Parsl

Описание к видео Scalabe Molecular Simulations Using Parsl

In this talk, Sander will discuss psiflow, a scalable molecular simulation framework that targets non-Parsl-savvy users. He’ll discuss the easy setup of Parsl providers and executors on clusters, combining containers and parallel efficiency, setting ulimits, and smarter Futures.

Speaker: Sander Vandenhaute
Session Date: August 20, 2024

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