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dfda591ee4
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do not include path to MPI stub lib for real MPI compile
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2013-08-13 01:00:24 +02:00 |
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3aede794af
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pair style eam may not be installed (yet)
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2013-08-13 00:59:47 +02:00 |
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1cdb01dfe3
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
Resolved Conflicts:
lib/atc/Makefile.mingw32-cross
lib/atc/Makefile.mingw32-cross-mpi
lib/atc/Makefile.mingw64-cross
lib/atc/Makefile.mingw64-cross-mpi
lib/atc/Makefile.serial
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2013-08-10 14:58:38 +02:00 |
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d56c9dfd27
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Removal of superfluous files from lib-atc repository.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10565 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-08-08 21:21:15 +00:00 |
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3c17e7c07c
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fix permissions
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2013-08-08 22:17:27 +02:00 |
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c52a54587a
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some tweaks to make the parallel makefile work more smoothly
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2013-08-08 22:12:20 +02:00 |
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08a91514de
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we must not version control binaries.
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2013-08-08 19:54:44 +02:00 |
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5fa5def2f9
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make AtC compatible with windows cross compiles
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2013-08-08 19:54:11 +02:00 |
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b806ad5c43
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add BLAS/LAPACK files required to support AtC 2.0
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2013-08-08 19:47:19 +02:00 |
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c99c117e6e
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ignore dependency files
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2013-08-08 19:40:26 +02:00 |
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6b0ec36c0d
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remove unwated files
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2013-08-08 19:39:55 +02:00 |
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4704ced070
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Updating libatc Makefiles to use only current version *.h and *.cpp files.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10564 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-08-08 15:34:04 +00:00 |
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c931a450c0
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Merge remote-tracking branch 'lammps-ro/master' into atc-merge
Resolved Conflicts:
doc/Manual.txt
src/USER-ATC/Install.sh
tools/msi2lmp/biosym_frc_files/README
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2013-08-08 14:02:03 +02:00 |
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7855ef6dda
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ATC version 2.0, date: Aug7
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10561 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-08-07 21:34:54 +00:00 |
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0e4d1e6b22
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ATC version 2.0, date: Aug7
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10557 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-08-07 21:29:01 +00:00 |
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9adfd0cac1
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10519 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-08-02 15:02:54 +00:00 |
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a6ceede04a
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implement a more portable version of the the clock_gettime workaround
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2013-08-01 10:47:30 +02:00 |
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c7e5039857
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10425 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-07-26 16:37:03 +00:00 |
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d65b922bb2
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10415 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-07-26 15:48:32 +00:00 |
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1a4bead190
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10414 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-07-26 15:43:29 +00:00 |
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434c695e39
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re-instate Makefile.lammps
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2013-07-26 11:40:02 +02:00 |
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e6f6722365
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make USER-CUDA compile with current LAMMPS-ICMS
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2013-07-26 11:02:01 +02:00 |
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b0007d45b7
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10199 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-06-29 21:27:42 +00:00 |
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e954b14d99
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10198 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-06-29 21:23:34 +00:00 |
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c7183e199a
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Merge remote branch 'lammps-ro/master' into lammps-icms
Resolved Conflicts:
doc/Manual.txt
lib/cuda/Makefile.lammps
src/MOLECULE/dihedral_charmm.cpp
src/pair.h
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2013-06-29 13:25:29 +02:00 |
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1cda7f63aa
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10166 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-06-28 19:32:18 +00:00 |
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bfbe995a9c
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10165 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-06-28 19:30:58 +00:00 |
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c3c4b74504
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add final EOL character
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2013-06-28 16:38:50 +02:00 |
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1c337c837c
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permission cleanup
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2013-06-28 13:15:10 +02:00 |
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2b1e3a30bd
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Merge remote branch 'lammps-ro/master' into lammps-icms
Resolved Conflicts:
doc/Manual.txt
doc/fix_tune_kspace.txt
doc/group2ndx.txt
src/DIPOLE/atom_vec_dipole.cpp
src/DIPOLE/pair_lj_long_dipole_long.cpp
src/MOLECULE/atom_vec_angle.cpp
src/MOLECULE/atom_vec_bond.cpp
src/MOLECULE/atom_vec_full.cpp
src/MOLECULE/atom_vec_molecular.cpp
src/PERI/atom_vec_peri.cpp
src/USER-AWPMD/atom_vec_wavepacket.cpp
src/USER-COLVARS/README
src/USER-EFF/atom_vec_electron.cpp
src/USER-SPH/atom_vec_meso.cpp
src/atom.h
src/atom_vec_atomic.cpp
src/atom_vec_body.cpp
src/atom_vec_charge.cpp
src/atom_vec_ellipsoid.cpp
src/atom_vec_line.cpp
src/atom_vec_sphere.cpp
src/atom_vec_tri.cpp
src/fix_restrain.cpp
src/force.cpp
tools/restart2data.cpp
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2013-06-28 13:09:52 +02:00 |
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7b2f24f051
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yet another path fix for x-compile.
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2013-06-28 11:12:11 +02:00 |
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e801cc0f39
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one more time
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2013-06-28 10:44:45 +02:00 |
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2020a3abbb
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two more paths need to be corrected
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2013-06-28 10:27:28 +02:00 |
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016dac9c11
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update gpu tool makefile for changed paths
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2013-06-28 10:21:23 +02:00 |
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6c4e44ad0d
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correct path to MPICH mpi library
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2013-06-28 06:53:55 +02:00 |
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8dc2a751a0
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makefiles for building the GPU library
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2013-06-28 02:31:13 +02:00 |
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7e0fef793d
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updates for compiling LAMMPS on windows with OpenCL support
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2013-06-28 01:50:42 +02:00 |
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6dc2447695
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10119 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-06-27 22:48:40 +00:00 |
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4da20dce99
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10118 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-06-27 22:48:27 +00:00 |
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a5d55a6f76
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documentation update for colvars
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2013-06-27 20:26:10 +02:00 |
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8b031ab609
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10099 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-06-27 14:21:12 +00:00 |
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f5bec5011a
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port to current mingw package
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2013-06-27 14:57:55 +02:00 |
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eee639db2f
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start of setting up building the gpu library
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2013-06-26 15:41:32 +02:00 |
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50a03de73b
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remove outdated msm gpu library code
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2013-06-26 11:40:00 +02:00 |
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fb8e8d0646
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try to handle dependency generation for AtC better
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2013-06-25 14:13:11 +02:00 |
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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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