Compiling NAMD on amd64

From: Wenyu Zhong (wyzhong78_at_163.com)
Date: Thu Apr 15 2004 - 01:42:17 CDT

• Next message: Hua Wong: "peptid bond omega, problems with settings?"
• Previous message: li: "fix or Harmonic constraint ?"
• Next in thread: Wenyu Zhong: "Re: Compiling NAMD on amd64"
• Reply: Wenyu Zhong: "Re: Compiling NAMD on amd64"
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

Hi,everyone!
    I have tried compiling NAMD 2.5 on opteron 242(1.6G), Rocks3.1.0 x86_64(RedHat 2.1EL).I compiled a Linux-amd64-g++ version successfully and it achived about 5.4s/step in running apoa1 benchmark .it is little slower than 5.1s/step got by the standard NAMD_2.5_Linux binary running on Xeon 2.4G.
    How do you think about the performance of the Linux-amd64-g++ version? Is there any optimization I should do? Do you think other compliers like pgcc will do much more better than gcc?
    Best regards!
Wenyu Zhong

• Next message: Hua Wong: "peptid bond omega, problems with settings?"
• Previous message: li: "fix or Harmonic constraint ?"
• Next in thread: Wenyu Zhong: "Re: Compiling NAMD on amd64"
• Reply: Wenyu Zhong: "Re: Compiling NAMD on amd64"
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:38:35 CST