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d45dd25ce6
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add wrapper makefiles that allow to use non-MPI libraries and makefiles
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2013-06-25 11:50:00 +02:00 |
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98b8a2c4f7
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add MPI support for AtC library
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2013-06-25 11:25:50 +02:00 |
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c9a59e36f9
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handle adjustable storage sizes correctly
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2013-06-25 07:35:01 +02:00 |
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865b3d696b
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cross compilation support in AtC
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2013-06-25 07:22:17 +02:00 |
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2e5f2ba1e8
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port AWPMD to cross compilation with mingw
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2013-06-25 00:31:43 +02:00 |
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0024e1afc3
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import changes from colvars repo
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2013-06-23 14:49:38 +02:00 |
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6f48ddb24f
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provide meaningful log message when re-initializing masses
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2013-06-19 00:51:12 +02:00 |
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7d444dcb71
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more changes to support late initialization of masses
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2013-06-19 00:22:43 +02:00 |
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5a7dd0e74e
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import colvar module changes that allow resetting masses
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2013-06-18 23:13:31 +02:00 |
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9eeccbfffb
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update for building lib/meam with mingw cross compilers
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2013-06-14 20:59:52 +02:00 |
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6018567134
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tweak to colvarmodule output
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2013-06-14 12:19:40 +02:00 |
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8cd52ce9a9
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update colvars library
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2013-06-13 14:51:34 +02:00 |
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0b32ec3147
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remove comment within comment
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2013-06-11 09:17:10 +02:00 |
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0567f76d4c
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small updates/corrections from giacomo
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2013-06-11 06:16:49 +02:00 |
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e038893385
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whitespace fixes in colvars library
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2013-06-10 14:47:15 +02:00 |
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df0dcfd99b
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avoid spurious error on clean target
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2013-06-09 16:31:08 +02:00 |
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73452096d6
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fix compile error
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2013-06-09 16:26:34 +02:00 |
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e240e15c4d
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
Resolved Conflicts:
doc/Manual.txt
src/USER-MISC/dihedral_nharmonic.cpp
src/USER-MISC/pair_lj_sf_dipole_sf.h
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2013-06-09 14:35:36 +02:00 |
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3e5c7ae60f
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10053 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-06-08 21:43:17 +00:00 |
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3d664382ae
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update version number
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2013-06-07 14:43:39 +02:00 |
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df08be2f01
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update colvars library from github repo
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2013-06-07 14:39:17 +02:00 |
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916211df33
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updated the README with github URLs
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2013-06-07 14:33:47 +02:00 |
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6354d994c2
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ignore Makefile.lammps entries as they are generated
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2013-06-07 14:25:45 +02:00 |
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2a9ada3ce4
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update makefiles to reflect changes in the build procedure
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2013-06-07 14:25:01 +02:00 |
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a87e2f8709
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fix up build system
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2013-06-05 14:14:59 +02:00 |
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77ed62b93b
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update of colvars library
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2013-06-05 14:12:27 +02:00 |
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5da358bf54
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add makefiles for building 32-bit executables on 64-bit x86 Linux
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2013-06-01 18:34:50 +02:00 |
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ae439884d4
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port makefiles to changed build in lib/ tree
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2013-06-01 18:33:30 +02:00 |
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ce2b853e4a
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Merge remote branch 'lammps-ro/master' into lammps-icms
Resolved Conflicts:
doc/Eqs/pair_gauss.jpg
doc/Manual.txt
doc/pair_list.html
doc/pair_list.txt
lib/atc/Makefile.lammps.linalg
lib/awpmd/Makefile.lammps.linalg
lib/gpu/Makefile.lincoln
lib/linalg/Makefile.gfortran
lib/linalg/Makefile.mingw_cross
lib/linalg/README
lib/reax/Makefile.lammps
src/USER-CG-CMM/Install.sh
src/USER-COLVARS/Install.sh
src/USER-CUDA/Install.sh
src/USER-MISC/Install.sh
src/USER-MISC/pair_list.cpp
src/USER-OMP/Install.sh
src/USER-PHONON/Install.sh
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2013-06-01 13:53:34 +02:00 |
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52b3a24e2a
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9992 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-31 15:37:58 +00:00 |
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bc5c1ace49
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9991 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-31 15:37:37 +00:00 |
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4c5ae335d4
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9990 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-31 15:36:13 +00:00 |
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2a70442035
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9989 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-31 15:35:54 +00:00 |
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6b0299ef8b
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9983 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-30 21:04:06 +00:00 |
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e56c4a1358
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9981 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-30 20:34:41 +00:00 |
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7644b9955f
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9980 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-30 20:10:54 +00:00 |
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a4930c44c3
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9979 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-30 20:10:14 +00:00 |
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5c541cb43a
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9978 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-30 20:04:31 +00:00 |
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c95b44619c
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9977 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-30 19:58:20 +00:00 |
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5da43fc24a
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9976 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-30 19:56:15 +00:00 |
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d3bcb18506
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9975 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-30 19:53:03 +00:00 |
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73075ec5fe
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9974 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-05-30 19:48:45 +00:00 |
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2013-05-30 19:47:30 +00:00 |
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a60b4a249e
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2013-05-30 19:44:01 +00:00 |
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c5bdb0c989
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2013-05-30 19:43:25 +00:00 |
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2013-05-30 19:39:16 +00:00 |
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2013-05-30 19:28:38 +00:00 |
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2013-05-30 19:26:34 +00:00 |
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2013-05-30 19:22:07 +00:00 |
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