Candidate_v1.7.0
        stable
      
      
        
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            Last change
 on this file since 1ca493a was             67ab71, checked in by Frederik Heber <heber@…>, 13 years ago           | 
        
        
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FIX: default's resSeq in TremoloParser written inconsistently. 
 
- TremoloParser::saveLine() would add +1 to moleculeId but not else. Hence,
if we load a .xyz file and store as .data, the resSeq is 1. If some default
value has been set before, it would be 0. Also, it would get parsed as 1 and
wrongly stored as 0 (see e.g. Parser/Tremolo's pre and post test.data).
 - TESTFIX: new Parser/Tremolo/post/test_xyz.data to check correct default
value used in testsuite-parser-tremolo-save.
 - TESTFIX: Modified Parser/Tremolo/post/test.data as parsed value is 1.
 - TESTFIX: Modified Parser/Tremolo-Potentials/post/test.data as default value
is 0 (pre is .xyz file).
  
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            File size:
            281 bytes
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| Rev | Line |   | 
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| [305e7e] | 1 | # ATOMDATA      Charge  F       GroupMeasureTypeNo      GrpTypeNo       Id      chainID charge  extType imprData        name    neighbors       occupancy       resName resSeq  segID   stress  tempFactor      torsion type    u       x
 | 
|---|
| [67ab71] | 2 | 0       0       0       0       0       0       1       0       0       -       -       -       0       -       0       0       0       0       -       Ar      0       0       0       4.72977 8       8       
 | 
|---|
 | 3 | 0       0       0       0       0       0       2       0       0       -       -       -       0       -       0       0       0       0       -       Ar      0       0       0       7.3     8       8       
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