Diffusion lammps (lammps-icms) History

lammps/tools/rpm/lammps.spec
lammps-icmse0aab3f64fb3e55ff59ce2a…

Nov 26 2014

update status message
e0aab3f64fb3
·Axel Kohlmeyer on Nov 26 2014, 21:33.

Sep 26 2014

update build scripts for steve's make system updates
838ca5f5d3f2
·Axel Kohlmeyer on Sep 26 2014, 22:01.

Aug 19 2014

need to request 64-byte memory alignment to be compatible with USER-INTEL
d2502b791463
·Axel Kohlmeyer on Aug 19 2014, 16:25.

Jun 25 2014

disable KOKKOS from pre-compiled packages.
71ed5e51d2f1
·Axel Kohlmeyer on Jun 25 2014, 21:44.

Jan 23 2014

update build scripts for rpm and mingw to support MPIIO package
948dc517e299
·Axel Kohlmeyer on Jan 23 2014, 23:47.

Dec 16 2013

include abf_integrate tool from colvars into precompiled packages
dcbf3b993186
·Axel Kohlmeyer on Dec 16 2013, 14:13.

Nov 20 2013

update for new releases of fedora (20) and opensuse (13.1)
a64f7f239eeb
·Axel Kohlmeyer on Nov 20 2013, 18:14.

Nov 9 2013

handle the fact that USER-LB cannot be used without a real MPI library
b22f1876dcd1
·Axel Kohlmeyer on Nov 9 2013, 15:09.

Nov 3 2013

adapt for recent changes in LAMMPS-ICMS
e03a6e9fa5f1
·Axel Kohlmeyer on Nov 3 2013, 12:15.

Oct 26 2013

update rpm build instructions and script for newly added PNG support
823c3f902013
·Axel Kohlmeyer on Oct 26 2013, 21:49.

Oct 11 2013

prepare build scripts for inclusion of USER-QMMM into LAMMPS-ICMS
4f7278987022
·Axel Kohlmeyer on Oct 11 2013, 16:37.

Sep 21 2013

fix typo
32c0368d93ee
·Axel Kohlmeyer on Sep 21 2013, 16:48.
include createatoms in binary packages
b1a183ffa6ed
·Axel Kohlmeyer on Sep 21 2013, 16:22.

Aug 26 2013

add forgotten %endif
15d40dffa57a
·Axel Kohlmeyer on Aug 26 2013, 19:34.
add support for newer MPICH packages on FC18/19 (v2.x vs. v3.x)
1ff5b2487a55
·Axel Kohlmeyer on Aug 26 2013, 19:23.

Aug 2 2013

fix typo
c07625e15b3c
·Axel Kohlmeyer on Aug 2 2013, 19:43.
rename $BIOSYM_LIBRARY to $MSI2LMP_LIBRARY and biosym_frc_files for frc_files
60ac646a0ce3
·Axel Kohlmeyer on Aug 2 2013, 19:17.
include msi2lmp test examples and data file in common package as example
431a1b68a2fd
·Axel Kohlmeyer on Aug 2 2013, 14:15.

Jul 9 2013

fix build issue with msi2lmp potentials
d7fedb825e1f
·Axel Kohlmeyer on Jul 9 2013, 13:47.

Jul 7 2013

support potential/forcefield environment variables and include msi2lmp
cbd640ab048c
·Axel Kohlmeyer on Jul 7 2013, 15:16.

Jul 4 2013

compile rpms with high-resolution timer support
a63d3d0f8ef4
·Axel Kohlmeyer on Jul 4 2013, 18:37.

Jun 27 2013

compile binary2txt and restart2data with proper integer size flags
5e60d2c48468
·Axel Kohlmeyer on Jun 27 2013, 15:00.

Jun 18 2013

support switching to -DLAMMPS_SMALLSMALL on 32-bit platforms
8f1e6abfa7f2
·Axel Kohlmeyer on Jun 18 2013, 20:24.

Jun 15 2013

adjust installation location of OpenMPI binaries on SuSE
111741aeb769
·Axel Kohlmeyer on Jun 15 2013, 16:57.

Jun 14 2013

include (most) example input decks
539414a2816c
·Axel Kohlmeyer on Jun 14 2013, 18:20.
minor tweaks
759c5c8b60f3
·Axel Kohlmeyer on Jun 14 2013, 12:31.
update URL to prebuilt rpms
1d7a80f12be7
·Axel Kohlmeyer on Jun 14 2013, 12:20.

Jun 13 2013

rpm packaging improvements
540682f9bc12
·Axel Kohlmeyer on Jun 13 2013, 19:05.

Jun 11 2013

no need for python-devel package with ctypes
f7b041fe671c
·Axel Kohlmeyer on Jun 11 2013, 10:53.

Jun 10 2013

update spec file to work on OpenSuSE 12.3
bdf796f136f4
·Axel Kohlmeyer on Jun 10 2013, 14:45.

Jun 9 2013

update spec file for current fedora
cfef35fab71d
·Axel Kohlmeyer on Jun 9 2013, 21:43.

May 1 2010

include fist stab as rpm building for LAMMPS.
48ca39dceee8
·Axel Kohlmeyer on May 1 2010, 03:01.