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One-click-for-Gromacs-GPU

integration_instructionsResearch softwarekeyboard_double_arrow_right Software 25 Jan 2025Publisher:Zenodo
Authors: Li, Lejun; BNDS-China;

doi: 10.5281/zenodo.14740879 , 10.5281/zenodo.14740859 , 10.5281/zenodo.14738588 , 10.5281/zenodo.14738823

One-click-for-Gromacs-GPU

Abstract

A one click install Gromacs-GPU bash file for Ubuntu-WSL2 You need to install cuda driver for WSL, and then download the file and drop to /home/(your username), and then "bash gromacs-2024.3.bsh" to start install. If an error occurs after installation, you will need to manually edit the .bashrc file and add double quotes around the export lines that contain spaces.(I think this is an error caused by windows) Already test in Windows10,Ubuntu-WSL2, test video https://www.bilibili.com/video/BV1HzffYtERD

Keywords

One-click-install, Gromacs

  • BIP!
    Impact byBIP!
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    This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
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    popularity
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    		 Average
    influence
    This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
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    impulse
    This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
0
Average
Average
Average