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root/group/trunk/OOPSE/libmdtools/AtomVisitor.cpp
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Comparing trunk/OOPSE/libmdtools/AtomVisitor.cpp (file contents):
Revision 1118 by tim, Mon Apr 19 03:52:27 2004 UTC vs.
Revision 1126 by tim, Tue Apr 20 05:39:38 2004 UTC

# Line 2 | Line 2
2   #include "AtomVisitor.hpp"
3   #include "DirectionalAtom.hpp"
4   #include "MatVec3.h"
5 + #include "RigidBody.hpp"
6  
7 + void BaseAtomVisitor::visit(RigidBody* rb){
8 +  //vector<Atom*> myAtoms;
9 +  //vector<Atom*>::iterator atomIter;
10 +
11 +  //myAtoms = rb->getAtoms();
12 +  
13 +  //for(atomIter = myAtoms.begin(); atomIter != myAtoms.end(); ++atomIter)
14 +  //  (*atomIter)->accept(this);
15 + }
16 +
17   void BaseAtomVisitor::setVisited(Atom* atom){
18    GenericData* data;
19    data = atom->getProperty("VISITED");
# Line 43 | Line 54 | void SSDAtomVisitor::visit(DirectionalAtom* datom){
54    bool haveAtomData;
55    
56    //if atom is not SSD atom, just skip it
57 <  if(!strcmp(datom->getType(), "SSD"))
57 >  if(strcmp(datom->getType(), "SSD"))
58      return;
59  
60    data = datom->getProperty("ATOMDATA");
# Line 129 | Line 140 | void SSDAtomVisitor::visit(DirectionalAtom* datom){
140  
141   }
142  
143 + const string SSDAtomVisitor::toString(){
144 +  char buffer[65535];
145 +  string result;
146 +  
147 +  sprintf(buffer ,"------------------------------------------------------------------\n");
148 +  result += buffer;
149 +
150 +  sprintf(buffer ,"Visitor name: %s\n", visitorName.c_str());
151 +  result += buffer;
152 +
153 +  sprintf(buffer , "Visitor Description: Convert SSD into 4 differnet atoms\n");
154 +  result += buffer;
155 +
156 +  sprintf(buffer ,"------------------------------------------------------------------\n");
157 +  result += buffer;
158 +
159 +  return result;
160 + }
161 +
162 + //----------------------------------------------------------------------------//
163 +
164   void DefaultAtomVisitor::visit(Atom* atom){
165    AtomData* atomData;
166    AtomInfo* atomInfo;
# Line 138 | Line 170 | void DefaultAtomVisitor::visit(Atom* atom){
170      return;
171  
172   atomInfo =new AtomInfo;
173 +
174 +  atomData = new AtomData;
175 +  atomData->setID("ATOMDATA");
176  
177    atom->getPos(pos);
178    atomInfo->AtomType = atom->getType();
# Line 148 | Line 183 | void DefaultAtomVisitor::visit(Atom* atom){
183    atomInfo->dipole[1] = 0.0;
184    atomInfo->dipole[2] = 0.0;
185  
186 <  atomData = new AtomData;
187 <  atomData->setID("ATOMDATA");
186 >
187 >  atomData->addAtomInfo(atomInfo);
188 >  
189    atom->addProperty(atomData);
190  
191    setVisited(atom);
# Line 166 | Line 202 | void DefaultAtomVisitor::visit(DirectionalAtom* datom)
202    datom->getPos(pos);
203    datom->getU(u);
204  
205 +  atomData = new AtomData;
206 +  atomData->setID("ATOMDATA");
207    atomInfo =new AtomInfo;
208    
209    atomInfo->AtomType = datom->getType();
# Line 176 | Line 214 | void DefaultAtomVisitor::visit(DirectionalAtom* datom)
214    atomInfo->dipole[1] = u[1];
215    atomInfo->dipole[2] = u[2];  
216  
217 <  atomData = new AtomData;
218 <  atomData->setID("ATOMDATA");
217 >  atomData->addAtomInfo(atomInfo);
218 >
219    datom->addProperty(atomData);
220  
221    setVisited(datom);
222   }
223 <    
223 >
224 >
225 > const string DefaultAtomVisitor::toString(){
226 >  char buffer[65535];
227 >  string result;
228 >  
229 >  sprintf(buffer ,"------------------------------------------------------------------\n");
230 >  result += buffer;
231 >
232 >  sprintf(buffer ,"Visitor name: %s\n", visitorName.c_str());
233 >  result += buffer;
234 >
235 >  sprintf(buffer , "Visitor Description: copy atom infomation into atom data\n");
236 >  result += buffer;
237 >
238 >  sprintf(buffer ,"------------------------------------------------------------------\n");
239 >  result += buffer;
240 >
241 >  return result;
242 > }    

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