Candidate_v1.6.1
        Candidate_v1.7.0
        ChemicalSpaceEvaluator
        PythonUI_with_named_parameters
        TremoloParser_IncreasedPrecision
        stable
      
      
        
          | Last change
 on this file since e7ad08 was             f56e14, checked in by Frederik Heber <frederik.heber@…>, 8 years ago | 
        
          | 
Added Examples testcase for the many ways to translate an atom blog entry.
 | 
        
          | 
              
Property                 mode
 set to                 100644 | 
        
          | File size:
            1.1 KB | 
      
      
| Rev | Line |  | 
|---|
| [4464ef] | 1 | # | 
|---|
|  | 2 | #    MoleCuilder - creates and alters molecular systems | 
|---|
|  | 3 | #    Copyright (C) 2008-2012 University of Bonn | 
|---|
|  | 4 | # | 
|---|
|  | 5 | #    This program is free software: you can redistribute it and/or modify | 
|---|
|  | 6 | #    it under the terms of the GNU General Public License as published by | 
|---|
|  | 7 | #    the Free Software Foundation, either version 3 of the License, or | 
|---|
|  | 8 | #    (at your option) any later version. | 
|---|
|  | 9 | # | 
|---|
|  | 10 | #    This program is distributed in the hope that it will be useful, | 
|---|
|  | 11 | #    but WITHOUT ANY WARRANTY; without even the implied warranty of | 
|---|
|  | 12 | #    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the | 
|---|
|  | 13 | #    GNU General Public License for more details. | 
|---|
|  | 14 | # | 
|---|
|  | 15 | #    You should have received a copy of the GNU General Public License | 
|---|
|  | 16 | #    along with this program.  If not, see <http://www.gnu.org/licenses/>. | 
|---|
|  | 17 | # | 
|---|
|  | 18 | AT_BANNER([MoleCuilder - Examples]) | 
|---|
|  | 19 |  | 
|---|
|  | 20 | # simple test with h2o | 
|---|
|  | 21 | m4_include([Simple/testsuite-examples-simple-h2o.at]) | 
|---|
| [51662a] | 22 |  | 
|---|
|  | 23 | # testing partial charges fitting | 
|---|
|  | 24 | m4_include([PartialChargeFitting/testsuite-examples-partialchargefitting-h2o.at]) | 
|---|
| [f56e14] | 25 |  | 
|---|
|  | 26 | # BLOG: Many ways to translate an atom | 
|---|
|  | 27 | m4_include([ManyWaysTranslateAtom/testsuite-examples-many-ways-translate-atom.at]) | 
|---|
       
      
  Note:
 See   
TracBrowser
 for help on using the repository browser.