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root/group/trunk/OOPSE/samples/water/tip4p/water.mdl
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Comparing trunk/OOPSE/samples/water/tip4p/water.mdl (file contents):
Revision 1326 by chrisfen, Thu Jul 15 19:28:18 2004 UTC vs.
Revision 1329 by chrisfen, Thu Jul 15 19:43:43 2004 UTC

# Line 164 | Line 164 | molecule{
164   }
165  
166   molecule{
167 +  name = "SPC";
168 +  nAtoms = 3;
169 +  atom[0]{
170 +    type = "O_SPC";
171 +    position( 0.0, 0.0, -0.06461 );
172 +  }
173 +  atom[1]{
174 +    type = "H_SPC";
175 +    position( 0.0, 0.81649, 0.51275 );
176 +  }
177 +  atom[2]{
178 +    type = "H_SPC";
179 +    position( 0.0, -0.81649, 0.51275 );
180 +  }
181 +  nRigidBodies = 1;
182 +  rigidBody[0]{
183 +    nMembers = 3;
184 +    members(0, 1, 2);
185 +  }
186 +
187 +  nCutoffGroups = 1;
188 +  cutoffGroup[0]{
189 +    nMembers = 3;
190 +    members(0, 1, 2);
191 +  }
192 + }
193 +
194 + molecule{
195    name = "DPD";
196    nAtoms = 1;
197    atom[0]{

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