Re: Running NAMD Singularity container on GPU multinode cluster with Omnipath

From: Giacomo Fiorin (giacomo.fiorin_at_gmail.com)
Date: Fri Jan 21 2022 - 07:51:33 CST

In that case, reading between the lines it seems that the build was made
for InfiniBand, most likely using the "ibverbs" backend for Charm++. I
have never used an Omnipath cluster myself, but you are likely to need a
custom build:
https://www.ks.uiuc.edu/Research/namd/2.14/ug/node102.html

Giacomo

This archive was generated by hypermail 2.1.6 : Tue Dec 13 2022 - 14:32:44 CST