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585a65c560
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update colvars to version 2015-07-21
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2015-07-21 13:25:28 -04:00 |
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c67b0f5aa3
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
# Conflicts:
# doc/Manual.html
# doc/Manual.txt
# doc/read_restart.txt
# src/atom.cpp
# src/read_data.cpp
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2015-07-18 12:29:27 -04:00 |
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4e757218e4
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Adding missing Kokkos file
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13636 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-07-17 16:17:51 +00:00 |
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546a777f2a
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avoid underflows with exponentials
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2015-07-16 16:57:57 -04:00 |
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0d27fd720d
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
# Conflicts:
# doc/Manual.html
# doc/Manual.txt
# lib/kokkos/Makefile.lammps
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2015-07-15 06:51:10 -04:00 |
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61ec2f78ac
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13583 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-07-14 19:57:25 +00:00 |
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26b23a47cd
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13581 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-07-14 19:55:01 +00:00 |
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4e9e96d713
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also compile voro++ executable for other uses
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2015-07-07 11:35:36 -04:00 |
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32f313c2db
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
# Conflicts:
# doc/Manual.html
# doc/Manual.txt
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2015-07-02 08:34:17 -04:00 |
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ade2dca6af
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13506 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-07-02 00:45:28 +00:00 |
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2b605e29db
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Describes new QUIP directory structure
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13499 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-07-01 21:02:16 +00:00 |
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7ecae004e4
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Merge branch 'lammps-icms' of bitbucket.org:akohlmey/lammps-icms into lammps-icms
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2015-06-29 15:04:00 -04:00 |
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6b8b7c14a6
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compile qm/mm library with -fPIC to be compatible with shared library builds
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2015-06-29 14:36:36 -04:00 |
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0b819b40d6
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
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2015-06-27 15:19:56 -04:00 |
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12b5742f6c
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Updated to new QUIP directory structure
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13493 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-06-23 23:18:51 +00:00 |
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417a56728c
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more fixes for C++11 compatibility
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2015-06-17 16:40:25 -04:00 |
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d35e3291a3
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removed dead code and silence warnings about C++ standard violations
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2015-06-17 15:56:14 -04:00 |
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8a6f242800
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fix OpenMP incompatibility when using CUDA through nvcc
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2015-06-17 13:53:43 -04:00 |
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938c85964b
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make library compiles compatible with building a shared object
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2015-06-05 12:13:31 -04:00 |
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c3fd41010d
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13464 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-05-15 16:33:17 +00:00 |
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f084911239
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fix known inconsistencies with exclusions for coul/dsf styles
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2015-05-14 17:48:03 -04:00 |
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c676c2d560
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13445 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-04-30 14:10:18 +00:00 |
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f539e43b22
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13444 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-04-30 14:09:42 +00:00 |
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673154cad3
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update colvars library to the latest bugfixes as of 2015-04-22
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2015-04-22 20:35:20 -04:00 |
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2a20dc2ef9
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update colvars to version 2015-04-03
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2015-04-18 19:43:44 -04:00 |
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448f7b91c0
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
Resolved Conflicts:
doc/Manual.html
doc/Manual.txt
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2015-04-12 07:33:06 -04:00 |
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29e574b720
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13400 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-04-11 23:13:07 +00:00 |
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aa9068187f
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
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2015-04-07 06:50:49 -04:00 |
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974e1eb022
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13396 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-04-06 15:14:53 +00:00 |
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2729e19d4a
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Added one-liner for QUIP
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13394 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-04-06 14:37:39 +00:00 |
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4799e0c322
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GPU update from trung
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2015-03-27 12:24:55 -04:00 |
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05eacff252
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
Resolved Conflicts:
doc/Manual.html
doc/Manual.txt
src/Make.py
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2015-03-19 09:13:20 -04:00 |
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4825579470
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13252 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-03-18 21:39:32 +00:00 |
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636ef51ae4
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13251 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-03-18 20:45:12 +00:00 |
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a982178cea
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self-configuring variant of python library support
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2015-03-18 15:13:02 -04:00 |
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54233c58b1
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
Resolved Conflicts:
doc/Manual.html
doc/Manual.txt
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2015-03-18 07:26:15 -04:00 |
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5e0e0c3838
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13248 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-03-17 23:13:10 +00:00 |
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141569b290
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13246 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-03-17 23:09:56 +00:00 |
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ad91adbedc
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13241 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-03-17 16:08:01 +00:00 |
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c63d258cc0
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13239 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-03-17 16:06:12 +00:00 |
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945fea8e40
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update colvars library to state of 2015-03-15
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2015-03-16 14:00:45 -04:00 |
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2a773a9a97
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update colvars to 2015-03-12 version
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2015-03-13 11:08:31 -04:00 |
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5a0a8f1335
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13207 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-03-09 14:50:53 +00:00 |
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13e37b7d0d
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update colvars library to state of feb 27th
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2015-03-06 10:49:39 -05:00 |
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09bb220083
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
Resolved Conflicts:
doc/Manual.html
doc/Manual.txt
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2015-02-25 17:03:53 -05:00 |
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02d90d07e6
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13151 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-02-24 16:29:22 +00:00 |
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067833cf07
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13126 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-02-19 18:20:52 +00:00 |
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f082916333
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update colvars to version 2015-02-04
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2015-02-17 14:22:20 -05:00 |
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4fdb97ee48
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
Resolved Conflicts:
doc/Manual.html
doc/Manual.txt
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2015-02-05 10:36:13 -05:00 |
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a2aa6c5be0
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13057 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-02-04 22:09:15 +00:00 |
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