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[ESPResSo-users] ADRess trouble


From: Nicola Fortunati
Subject: [ESPResSo-users] ADRess trouble
Date: Tue, 06 Sep 2011 09:55:49 +0200
User-agent: Mozilla/5.0 (X11; U; Linux x86_64; en-US; rv:1.9.2.20) Gecko/20110817 Fedora/3.1.12-1.fc14 Thunderbird/3.1.12

Hi Espresso users,

i want to install ADRESS FEATURE in my ESPRESSO CODE.
After compile, make and make check i tested Adress tcl script and ESPRESSO returned this message:

address@hidden espresso-3.0.1]# ./Espresso ./samples/adress/Adress_t.tcl
0: Script directory: /home/nicolafortunati/Scrivania/espresso-3.0.1/scripts
*******************************************************
*                                                     *
*                    - ESPResSo -                     *
*                    ============                     *
*        A Parallel Molecular Dynamics Program        *
*                                                     *
* (c) 2010,2011                                       *
* The ESPResSo project                                *
*                                                     *
* (c) 2002,2003,2004,2005,2006,2007,2008,2009,2010    *
* Max-Planck-Institute for Polymer Research           *
* Mainz, Germany                                      *
*                                                     *
*******************************************************

ESPResSo is free software: you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation, either version 3 of the License, or
(at your option) any later version.

ESPResSo is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
GNU General Public License for more details.

You should have received a copy of the GNU General Public License
along with this program.  If not, see <http://www.gnu.org/licenses/>.

 
=======================================================
=              Script:  Adress_t.tcl                  =
=======================================================
 
Program Information:
ESPResSo: 3.0.1
{ Compilation status { FFTW } { PARTIAL_PERIODIC } { ELECTROSTATICS } { MASS } { EXTERNAL_FORCES } { CONSTRAINTS } { EXCLUSIONS } { COMFORCE } { COMFIXED } { TABULATED } { LENNARD_JONES } { LENNARD_JONES_GENERIC } { MORSE } { BUCKINGHAM } { SOFT_SPHERE } { LJCOS } { LJCOS2 } { BOND_ANGLE_COSINE } { NPT } }
{ Debug status { MPI_CORE FORCE_CORE } }

Adress is not compiled in (change config.h).
    while executing
"adress set topo $topo_kind width [expr $ex_width*0.5] $hyb_width center x $ex_center wf $wf "
    (file "./samples/adress/Adress_t.tcl" line 65)


What can i do??I think ADRESS is compiled!!
Do i change /espresso-3.0.1/src/config.h
or /espresso-3.0.1/myconfig-sample.h????And what do i change???

Thanx

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