AMBER Archive (2004)

Subject: Re: AMBER:

From: David A. Case (case_at_scripps.edu)
Date: Fri Jul 30 2004 - 10:06:56 CDT


On Fri, Jul 30, 2004, csong_at_mail.sdu.edu.cn wrote:
>
> How to set the MKL_HOME when using ifc7 to compile AMBER?
> I have set it and finished compiling.But when I tested, it said:
>
> cd dmp; ./Run.dmp
> ../../exe/sander: error while loading shared libraries: libvml.so: cannot open
> shared object file: No such file or directory
> ./Run.dmp: Program error
> make: *** [test.sander.no_lmod] Error 1
>

You need to have the MKL location in your LD_LIBRARY_PATH environment
variable. For example, my variable looks like this:

/opt/intel/compiler70/ia32/lib:/opt/intel/mkl/lib/32

These are pretty standard locations for the compiler and MKL installations,
but of course, they may be located in different places on your computer.
Basically, once you find where libvml.so is on your machine, put its directory
into your LD_LIBRARY_PATH variable.

...good luck...dac

-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu