Robust and effective ab initio molecular dynamics simulations on the GPU cloud infrastructure using the Schrödinger Materials Science Suite-Reference-Cited by-同舟云学术

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Robust and effective ab initio molecular dynamics simulations on the GPU cloud infrastructure using the Schrödinger Materials Science Suite

Published:2024-09 Issue: Volume:244 Page:113188
ISSN:0927-0256
Container-title:Computational Materials Science
language:en
Short-container-title:Computational Materials Science

Author:

Fonari Alexandr,Agarwal Garvit,Tiwari Subodh C.,Brock Casey N.,Gavartin Jacob,Halls Mathew D.

Funder

Gates Ventures

Publisher

Elsevier BV

Reference29 articles.

1. Commentary: the materials project: a materials genome approach to accelerating materials innovation;Jain;APL Mater.,2013

2. Materials cloud, a platform for open computational science;Talirz;Sci. Data,2020

3. HPC cloud for scientific and business applications: taxonomy, vision, and research challenges;Netto;ACM Comput. Surv.,2018

4. Here today, gone tomorrow: exploiting transient servers in datacenters;Singh;IEEE Internet Comput.,2014

5. “Amazon AWS Spot Instance advisor.” Accessed: Apr. 15, 2024. [Online]. Available: https://aws.amazon.com/ec2/spot/instance-advisor/.

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