Re: not compiled with -DHAS_10_12!!

From: Sarah Tschampel <tschampe_at_sunchem.chem.uga.edu>
Date: Thu 5 Dec 2002 11:43:40 -0500 (EST)

The answer to the first question:

You have to add the -DHAS_10_12 flag to your machine file under setenv
MACHINEFLAGS and recompile - and this should get rid of the problem.

-sarah


On Thu, 5 Dec 2002, William Wei wrote:

> Hi all,
>
> While I run my minimization, sander told me:
> | Max Nonbonded Pairs:********
> Found a non-zero 10-12 coefficient, but source
> was not compiled with -DHAS_10_12.
> If you are using a pre-1994 force field, you
> will need to re-compile with this flag.
>
> So where can I set it up? Thank you.
>
> Another question is with my compiling of mm_pbsa:
> ../Compile LOAD -o make_crd_hg make_crd_hg.o ../lib/amopen.o
> ../lib/mexit.o
> /usr/people/tripos/mpich/mpich-1.2.4/lib/mpif77 -o make_crd_hg make_crd_hg.o
> ../lib/amopen.o ../lib/mexit.o -lblas -lcomplib.sgimath -lfastm
> ld64: WARNING 84 : /usr/lib64/mips4/libblas.so is not used for resolving any
> symbol.
> ld64: WARNING 84 : /usr/people/tripos/mpich/mpich-1.2.4/lib/libmpich.a is
> not used for resolving any symbol.
> don't know how to make molsurf.o (bu42).
>
> Can anyone give me clue that what is wrong with it?
>
> Have a good day,
>
> William
>
> -------------------------
> William Wei
> Faculty of Pharmacy
> 19 Russell Street
> Toronto, ON. M5S 2S2
> Tel: 1-416-946-8469
> Fax: 1-416-978-8511
> Email: william_at_phm.utoronto.ca
> william.wei_at_utoronto.ca
>
>
>
Received on Thu Dec 05 2002 - 08:43:40 PST
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