Re:

From: David Hardy (dhardy_at_ks.uiuc.edu)
Date: Sat Oct 27 2018 - 04:22:03 CDT

Hi Darin,

The CPU-only builds of NAMD provided for download are statically linked, so no environment variable is required, other than setting PATH to include the directory of the namd2 binary.

The CUDA builds of NAMD provided for download must dynamically link to the CUDA libraries. These are included in the same directory as the namd2 binary, which for Linux requires you to modify LD_LIBRARY_PATH to include that directory.

Best regards,
Dave

--
David J. Hardy, Ph.D.
Beckman Institute
University of Illinois at Urbana-Champaign
405 N. Mathews Ave., Urbana, IL 61801
dhardy_at_ks.uiuc.edu, http://www.ks.uiuc.edu/~dhardy/
> On Oct 27, 2018, at 12:22 AM, Darin Lory <darin.lory_at_gmail.com> wrote:
> 
> To Distribution,
> 
> Does anybody have the NAMD environment variables and paths defined in a Linux environment?
> 
> I'm working on a technical design document for our NAMD application environment running on AWS.
> 
> Modulefiles would also be apprecitated.
> 
> Thank you in advance,
> 
> Best regards,
> 
> -Darin
> 
> Darin S. Lory
> 

This archive was generated by hypermail 2.1.6 : Thu Dec 12 2019 - 23:20:11 CST