Candidate_v1.6.1
|
Last change
on this file since a844d8 was 67ab71, checked in by Frederik Heber <heber@…>, 12 years ago |
|
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).
|
-
Property mode
set to
100644
|
|
File size:
221 bytes
|
| Line | |
|---|
| 1 | # ATOMDATA Charge F GroupMeasureTypeNo GrpTypeNo Id chainID charge extType imprData name neighbors occupancy resName resSeq segID stress tempFactor torsion type u x
|
|---|
| 2 | 0 0 0 0 0 0 1 0 0 - - - 0 - 1 0 0 0 - H 0 0 0 10 10 10
|
|---|
Note:
See
TracBrowser
for help on using the repository browser.
