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[tsscds] Log of /trunk/scripts/tsscds.sh
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Log of /trunk/scripts/tsscds.sh

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Revision 293 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Wed Dec 12 16:42:09 2018 UTC (5 years, 5 months ago) by tsscds
File length: 26106 byte(s)
Diff to previous 279
tsscds freq for all but assoc

Revision 279 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Wed Jun 27 20:30:08 2018 UTC (5 years, 11 months ago) by baaden
File length: 26106 byte(s)
Diff to previous 241
move to trunk 1

Revision 241 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Wed Feb 21 14:03:50 2018 UTC (6 years, 3 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 26106 byte(s)
Diff to previous 235
inter=0 in assoc calcs in tsscds.sh

Revision 235 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Fri Dec 29 17:02:09 2017 UTC (6 years, 5 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 26095 byte(s)
Diff to previous 230
change in tsscds.sh to conform with new mopacl

Revision 230 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Tue Dec 5 12:25:36 2017 UTC (6 years, 5 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 26073 byte(s)
Diff to previous 229
supressed min0 keyword

Revision 229 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Mon Dec 4 18:49:13 2017 UTC (6 years, 5 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 26042 byte(s)
Diff to previous 228
sel_mol

Revision 228 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Mon Dec 4 17:48:33 2017 UTC (6 years, 5 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 26036 byte(s)
Diff to previous 183
added min0 keyword

Revision 183 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Wed Oct 11 06:58:30 2017 UTC (6 years, 7 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 25949 byte(s)
Diff to previous 182
en=100 now

Revision 182 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Tue Oct 10 16:12:27 2017 UTC (6 years, 7 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 25948 byte(s)
Diff to previous 180
s12<10 now

Revision 180 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Mon Oct 9 06:27:38 2017 UTC (6 years, 7 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 25948 byte(s)
Diff to previous 179
changes in ft2 default options and more

Revision 179 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Tue Sep 26 11:44:34 2017 UTC (6 years, 8 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 24461 byte(s)
Diff to previous 178
setting max value for emin0 and emax0

Revision 178 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Thu Sep 7 16:35:17 2017 UTC (6 years, 8 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 24377 byte(s)
Diff to previous 169
bug in tsscds with external

Revision 169 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Thu Aug 31 15:12:14 2017 UTC (6 years, 9 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 24576 byte(s)
Diff to previous 147
parallel shows numbers instead of file names and emaxts and emints removed

Revision 147 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Fri Aug 25 07:09:09 2017 UTC (6 years, 9 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 24634 byte(s)
Diff to previous 141
erange and trange automated

Revision 141 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Mon Aug 14 13:34:38 2017 UTC (6 years, 9 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 24568 byte(s)
Diff to previous 140
simplified input

Revision 140 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Mon Aug 14 05:25:51 2017 UTC (6 years, 9 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 23725 byte(s)
Diff to previous 117
simplified input files

Revision 117 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Fri Aug 4 12:57:40 2017 UTC (6 years, 9 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 23723 byte(s)
Diff to previous 106
removing error.log files

Revision 106 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Fri Aug 4 06:03:16 2017 UTC (6 years, 9 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 23733 byte(s)
Diff to previous 102
new seed for srand and symm changed to avoid overprinting

Revision 102 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Sun Jul 30 07:08:32 2017 UTC (6 years, 10 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 23588 byte(s)
Diff to previous 89
improving scripts

Revision 89 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Mon Jul 24 14:41:08 2017 UTC (6 years, 10 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 23544 byte(s)
Diff to previous 83
sqlite3 employed instead of rxyz at ll completed

Revision 83 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Sat Jul 22 19:27:45 2017 UTC (6 years, 10 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 23391 byte(s)
Diff to previous 82
sqlite3 only for track. back to tslistll

Revision 82 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Fri Jul 21 20:36:05 2017 UTC (6 years, 10 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 23263 byte(s)
Diff to previous 81
little changes

Revision 81 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Fri Jul 21 18:44:50 2017 UTC (6 years, 10 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 23237 byte(s)
Diff to previous 77
sqlite installed for tslist

Revision 77 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Fri Jul 21 13:09:41 2017 UTC (6 years, 10 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 22167 byte(s)
Diff to previous 60
nada

Revision 60 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Mon Jul 17 05:39:07 2017 UTC (6 years, 10 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 22160 byte(s)
Diff to previous 55
new script to avoid dependencies on mop files

Revision 55 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Sat Jul 15 05:23:17 2017 UTC (6 years, 10 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 22155 byte(s)
Diff to previous 47
changes in final.sh

Revision 47 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Fri Jul 14 11:23:06 2017 UTC (6 years, 10 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 22155 byte(s)
Diff to previous 44
reading molecule.xyz well

Revision 44 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Thu Jul 13 15:30:52 2017 UTC (6 years, 10 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 22139 byte(s)
Diff to previous 39
Included Barnes suggesting of flock in tsscds.sh and format changes

Revision 39 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Wed Jun 28 15:36:50 2017 UTC (6 years, 11 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 21764 byte(s)
Diff to previous 38
more traps

Revision 38 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Wed Jun 28 13:47:47 2017 UTC (6 years, 11 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 21640 byte(s)
Diff to previous 35
Clean exit of scripts with traps

Revision 35 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Fri Jun 23 11:49:49 2017 UTC (6 years, 11 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 21726 byte(s)
Diff to previous 31
define e0 correctly in tsscds.sh

Revision 31 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Thu Jun 22 13:05:03 2017 UTC (6 years, 11 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 21511 byte(s)
Diff to previous 25
minor modifications

Revision 25 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Wed Jun 21 15:25:57 2017 UTC (6 years, 11 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 21543 byte(s)
Diff to previous 24
more stuff into variables

Revision 24 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Wed Jun 21 11:34:40 2017 UTC (6 years, 11 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 21551 byte(s)
Diff to previous 23
changed various scripts to keep on moving stuff from files to variables in bash

Revision 23 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Wed Jun 21 05:05:30 2017 UTC (6 years, 11 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 21539 byte(s)
Diff to previous 22
temp now supports a range of T (in K)

Revision 22 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Tue Jun 20 16:11:39 2017 UTC (6 years, 11 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 20739 byte(s)
Diff to previous 21
new stuff in variables

Revision 21 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Tue Jun 20 16:01:06 2017 UTC (6 years, 11 months ago) by tsscds
Original Path: scripts/tsscds.sh
File length: 20698 byte(s)
Diff to previous 4
putting stuff in variables instead of files in main script

Revision 4 - (view) (download) (as text) (annotate) - [select for diffs]
Modified Mon Jun 19 10:49:20 2017 UTC (6 years, 11 months ago) by baaden
Original Path: scripts/tsscds.sh
File length: 20668 byte(s)
Diff to previous 1
autoconfiscating mostly done

Revision 1 - (view) (download) (as text) (annotate) - [select for diffs]
Added Tue Jun 13 20:26:10 2017 UTC (6 years, 11 months ago) by baaden
Original Path: bin/tsscds.sh
File length: 20668 byte(s)
the very fist check in

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