环境要求

CPU

鲲鹏920处理器

毕昇编译器和Hyper MPI

24.0.RC1

https://www.hikunpeng.com/developer/hpc/hpckit-download

NAMD

2.13

https://www.ks.uiuc.edu/Development/Download/download.cgi?PackageName=NAMD

Charm

6.9.0

https://charm.cs.illinois.edu/distrib/

TCL

8.5.9

http://www.ks.uiuc.edu/Research/namd/libraries/

FFTW

3.3.8

http://www.fftw.org/download.html

测试算例

Apoa1

https://www.ks.uiuc.edu/Research/namd/utilities/apoa1.tar.gz

openEuler

openEuler 21.03

https://www.openeuler.org/zh/download

Kernel

4.17

包含在操作系统镜像中。