[ViewVC] Log of: OpenMD/trunk/src/io/Globals.cpp

Revision 789 - (view) (annotate) - [select for diffs]
Modified Mon Dec 5 23:37:56 2005 UTC (19 years, 4 months ago) by tim
File length: 10929 byte(s)
Diff to previous 770

Fix parsing error in OptionSectionParser

Revision 770 - (view) (annotate) - [select for diffs]
Modified Fri Dec 2 15:38:03 2005 UTC (19 years, 5 months ago) by tim
File length: 10822 byte(s)
Diff to previous 765

End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser

Revision 765 - (view) (annotate) - [select for diffs]
Modified Mon Nov 21 22:59:36 2005 UTC (19 years, 5 months ago) by gezelter
File length: 16496 byte(s)
Diff to previous 749

parsing by filepp

Revision 749 - (view) (annotate) - [select for diffs]
Modified Wed Nov 16 23:10:02 2005 UTC (19 years, 5 months ago) by tim
File length: 16555 byte(s)
Diff to previous 748

OptionSectionParser get compiled

Revision 748 - (view) (annotate) - [select for diffs]
Modified Wed Nov 16 21:37:45 2005 UTC (19 years, 5 months ago) by chuckv
File length: 16245 byte(s)
Diff to previous 726

ForceField optional parameters....

Revision 726 - (view) (annotate) - [select for diffs]
Modified Fri Nov 11 15:22:11 2005 UTC (19 years, 5 months ago) by chrisfen
File length: 17295 byte(s)
Diff to previous 721

added in a 5th order polynomial switching function option

Revision 721 - (view) (annotate) - [select for diffs]
Modified Tue Nov 8 13:32:27 2005 UTC (19 years, 5 months ago) by chrisfen
File length: 17103 byte(s)
Diff to previous 716

Added a keyword and ability to output forces and torques

Revision 716 - (view) (annotate) - [select for diffs]
Modified Thu Nov 3 23:12:27 2005 UTC (19 years, 5 months ago) by chrisfen
File length: 17021 byte(s)
Diff to previous 710

improvements in shifted-force

Revision 710 - (view) (annotate) - [select for diffs]
Modified Wed Nov 2 20:36:25 2005 UTC (19 years, 6 months ago) by chrisfen
File length: 16979 byte(s)
Diff to previous 705

changing how we deal with summation and screening methods

Revision 705 - (view) (annotate) - [select for diffs]
Modified Tue Nov 1 19:14:27 2005 UTC (19 years, 6 months ago) by chrisfen
File length: 16786 byte(s)
Diff to previous 681

fixed a capitalization problem with NPT integrator initialization

Revision 681 - (view) (annotate) - [select for diffs]
Modified Mon Oct 17 23:13:44 2005 UTC (19 years, 6 months ago) by tim
File length: 16787 byte(s)
Diff to previous 674

Customized StatWriter is working

Revision 674 - (view) (annotate) - [select for diffs]
Modified Mon Oct 17 03:06:29 2005 UTC (19 years, 6 months ago) by tim
File length: 16670 byte(s)
Diff to previous 673

fix a seg fault when try copy a  string to event's err_msg, there are still tons of memory leaking problem in Globals

Revision 673 - (view) (annotate) - [select for diffs]
Modified Mon Oct 17 00:51:16 2005 UTC (19 years, 6 months ago) by tim
File length: 16177 byte(s)
Diff to previous 672

Change error message in Globals

Revision 672 - (view) (annotate) - [select for diffs]
Modified Fri Oct 14 21:43:13 2005 UTC (19 years, 6 months ago) by tim
File length: 15964 byte(s)
Diff to previous 666

Constraints for parameters are working now

Revision 666 - (view) (annotate) - [select for diffs]
Modified Fri Oct 14 14:18:02 2005 UTC (19 years, 6 months ago) by chrisfen
File length: 12338 byte(s)
Diff to previous 665

added default restraint spring constants into Globals

Revision 665 - (view) (annotate) - [select for diffs]
Modified Thu Oct 13 22:26:47 2005 UTC (19 years, 6 months ago) by tim
File length: 12033 byte(s)
Diff to previous 629

rewrite Globals

Revision 629 - (view) (annotate) - [select for diffs]
Modified Mon Sep 26 15:58:17 2005 UTC (19 years, 7 months ago) by chuckv
File length: 56090 byte(s)
Diff to previous 609

Added support for skinThickness keyword to Globals.

Revision 609 - (view) (annotate) - [select for diffs]
Modified Fri Sep 16 23:04:47 2005 UTC (19 years, 7 months ago) by chuckv
File length: 55264 byte(s)
Diff to previous 603

Added keywords for compressed dump files.

Revision 603 - (view) (annotate) - [select for diffs]
Modified Fri Sep 16 16:07:39 2005 UTC (19 years, 7 months ago) by chrisfen
File length: 54259 byte(s)
Diff to previous 598

some fixes but even more breaking (cutting out the old way to do reaction field)

Revision 598 - (view) (annotate) - [select for diffs]
Modified Thu Sep 15 00:14:35 2005 UTC (19 years, 7 months ago) by chrisfen
File length: 54843 byte(s)
Diff to previous 586

changes to include the coulombicCorrection selector

Revision 586 - (view) (annotate) - [select for diffs]
Modified Wed Sep 7 20:46:46 2005 UTC (19 years, 7 months ago) by gezelter
File length: 54435 byte(s)
Diff to previous 580

adding c-side interface to change cutoff Policy

Revision 580 - (view) (annotate) - [select for diffs]
Modified Tue Aug 30 18:23:50 2005 UTC (19 years, 8 months ago) by chrisfen
File length: 53560 byte(s)
Diff to previous 541

made some changes for implementing the wolf potential

Revision 541 - (view) (annotate) - [select for diffs]
Modified Sun May 22 21:05:15 2005 UTC (19 years, 11 months ago) by tim
File length: 52071 byte(s)
Diff to previous 539

adding keyword printPressureTensor

Revision 539 - (view) (annotate) - [select for diffs]
Modified Fri May 20 16:01:38 2005 UTC (19 years, 11 months ago) by tim
File length: 51107 byte(s)
Diff to previous 538

NPrT in progress

Revision 538 - (view) (annotate) - [select for diffs]
Modified Thu May 19 21:31:23 2005 UTC (19 years, 11 months ago) by tim
File length: 51105 byte(s)
Diff to previous 537

NPAT is working

Revision 537 - (view) (annotate) - [select for diffs]
Modified Thu May 19 15:49:53 2005 UTC (19 years, 11 months ago) by tim
File length: 51083 byte(s)
Diff to previous 536

fix bug in NPAT and NPrT

Revision 536 - (view) (annotate) - [select for diffs]
Modified Thu May 19 04:28:26 2005 UTC (19 years, 11 months ago) by tim
File length: 51095 byte(s)
Diff to previous 507

adding NPAT and NPrT integrators

Revision 507 - (view) (annotate) - [select for diffs]
Modified Fri Apr 15 22:04:00 2005 UTC (20 years ago) by gezelter
File length: 50147 byte(s)
Diff to previous 425

xemacs has been drafted to perform our indentation services

Revision 425 - (view) (annotate) - [select for diffs]
Modified Thu Mar 10 20:28:17 2005 UTC (20 years, 1 month ago) by tim
File length: 50167 byte(s)
Diff to previous 417

using map to replace link list

Revision 417 - (view) (annotate) - [select for diffs]
Modified Thu Mar 10 15:10:24 2005 UTC (20 years, 1 month ago) by chrisfen
File length: 49791 byte(s)
Diff to previous 404

First commit of the new restraints code

Revision 404 - (view) (annotate) - [select for diffs]
Modified Tue Mar 8 21:07:14 2005 UTC (20 years, 1 month ago) by gezelter
File length: 46958 byte(s)
Diff to previous 273

Dunno

Revision 273 - (view) (annotate) - [select for diffs]
Modified Tue Jan 25 17:45:23 2005 UTC (20 years, 3 months ago) by tim
File length: 46959 byte(s)
Diff to previous 246

(1) complete section parser's error message
(2) add GhostTorsion
(3) accumulate inertial tensor from the directional atoms before calculate rigidbody's inertial tensor

Revision 246 - (view) (annotate) - [select for diffs]
Modified Wed Jan 12 22:41:40 2005 UTC (20 years, 3 months ago) by gezelter
File length: 46427 byte(s)
Diff to previous 3

merging new_design branch into OOPSE-2.0

Revision 3 - (view) (annotate) - [select for diffs]
Modified Fri Sep 24 16:27:58 2004 UTC (20 years, 7 months ago) by tim
File length: 44315 byte(s)
Diff to previous 2

change the #include in source files

Revision 2 - (view) (annotate) - [select for diffs]
Added Fri Sep 24 04:16:43 2004 UTC (20 years, 7 months ago) by gezelter
File length: 44303 byte(s)

Import of OOPSE v. 2.0

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