[gmx-users] questions about pmetest.c
spoel at xray.bmc.uu.se
Thu Sep 15 07:53:47 CEST 2005
On Wed, 2005-09-14 at 18:18 -0400, Lei Zhou wrote:
> Dear gmx-users,
> I am trying to compile and install pmetest.c and got confused by
> automake, autoconf, etc.
> Here is what I did:
> follow the installation instruction to do ./configure under
> gromacs-3.3_rc2, goto the directory of src/contrib/, type make pmetest
> The following error message showed up:
> pmetest.c: In function `main':
> pmetest.c:395: error: too few arguments to function `init_forcerec'
> mpicc: No such file or directory
> make: *** [pmetest.o] Error 1
I'll fix it in a couple of days. Please file a bugzilla report to remind
> Another question about pmdtest: does it give Coul-LR for each energy
Not yet but it could actually be used for that.
> Thank you.
> Lei Zhou
> Columbia Unviersity, NY
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David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
spoel at xray.bmc.uu.se spoel at gromacs.org http://xray.bmc.uu.se/~spoel
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