ccdf359a90
Update version to 2.4.1
2023-10-24 10:23:04 +02:00
efd7fab7ed
state_id is an index+added energy
2023-05-12 01:33:57 +02:00
7edde4f1fb
Bump to version 2.3.2 with #118
2023-05-11 23:08:37 +02:00
d4d6da9850
Fix no-HDF5
2023-05-10 16:02:57 +02:00
13567fceb8
[wheel build] Set version number to 2.3.1 for fixing text backend in python
2023-04-26 10:10:42 +02:00
fbd44013db
Bumd the minor version after the release
2023-04-03 22:45:54 +02:00
fb711e1bed
Fixed #111
2023-01-20 10:31:56 +02:00
37fd013f6c
Improve HDF5 detection
2023-01-19 01:21:49 +01:00
fc7ddaddc0
Fixing HDF5 detection
2023-01-19 00:14:01 +01:00
0bda2330c7
Fix confgure.ac
2023-01-16 19:29:06 +01:00
5742221eb2
If header is not found, try pkgconfig
2023-01-16 19:26:52 +01:00
aa4e9ca7d3
Fixed pkg-config
2023-01-16 19:18:58 +01:00
8da5c2215b
Removed dependency on hdf5_hl
2023-01-16 14:54:17 +01:00
9355609ced
Rewrote HDF5 detection
2023-01-13 15:47:23 +01:00
69aa17862c
configure tries cp -r -n
2023-01-05 10:28:07 +01:00
fefc01b46b
Added trexio_cp
2023-01-03 18:29:21 +01:00
fb1dcb5fca
Added 'AM_PROG_CC_C_O' in 'configure.ac'
2022-12-13 17:09:10 +01:00
158f99bde9
Merge branch 'master' of github.com:TREX-CoE/trexio
2022-12-13 17:08:05 +01:00
4ac593351c
hdf5_hl
2022-12-13 17:07:57 +01:00
Evgeny Posenitskiy
34629c7d97
Update Debian files ( #100 )
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* Change debian files to avoid conflicts when packaging
2022-09-27 13:54:54 +02:00
5b5730ed81
Do not rely on the .git folder for TREXIO_DEVEL setup
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This poses issues when packaging for Guix and Debian
2022-09-26 17:06:04 +02:00
cd48a74fd7
Fixed 'warning: cannot check for file existence when cross compiling'
2022-09-06 17:19:38 +02:00
1fde6f9aa1
Optionally disable the Fortran tests in the user mode
2022-09-06 11:52:36 +02:00
e8dffaac15
Manually append -fPIC flag
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This solves issues with some compilers, e.g. Intel ones, which fail to resolve some linking symbols when configured in a simple manner (./configure CC=icc FC=ifort)
2022-07-12 17:07:38 +02:00
6d0293a379
Disable the malloc check to improve cross-compilation
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For example, compiling with gcc compiler with -fsanitize=address flag with use a different library for malloc-ing. This will fail if Autoconf add some symbols due to the use of AC_FUNC_MALLOC
2022-07-08 18:12:50 +02:00
189f6de6a9
Upgrade the minor versions after the release
2022-06-03 11:37:02 +02:00
3078f825e7
Revert "Upgrade the minor version before the release"
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This reverts commit 22531b47eb
2022-06-03 09:51:31 +02:00
22531b47eb
Upgrade the minor version before the release
2022-06-03 09:49:15 +02:00
f00505a763
Add configure --with-efence to debug memory issues
2022-05-06 11:07:26 +02:00
73d24e6def
Merged pseudo
2022-02-23 18:40:55 +01:00
6ab5c67ebe
[pre-release] upgrade versions and produce wheels for CPython 3.10
2021-12-27 16:26:17 +01:00
f89481fe60
Merge branch 'master' into cmake-and-guix
2021-11-18 13:59:05 +01:00
c5c4b7e473
Remove 2nd occurence of LT_INIT
2021-11-17 14:22:48 +01:00
4e20a5fde3
Modernize configure.ac
2021-11-17 14:16:55 +01:00
297552418b
add AC_CONFIG_AUX_DIR
2021-11-13 18:04:52 +01:00
42bf7ce94c
Store Git hash
2021-11-08 19:41:17 +01:00
cce0f49785
use HAVE_HDF5 instead of DO_HDF5 for conditional compilation
2021-11-02 10:32:51 +01:00
7d00b87ad8
Merge branch 'master' into optional-hdf5
2021-11-01 11:58:50 +01:00
d42dc7f449
optional HDF5 compilation
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via configure script and pre-processor macros
2021-11-01 11:55:34 +01:00
3154e01021
Merge branch 'configure' of github.com:TREX-CoE/trexio into configure
2021-11-01 10:16:14 +01:00
f0dd4563bc
Automatic developer mode
2021-11-01 10:16:02 +01:00
0a6c1dc65f
Removed TREXIO_DEVEL in configure
2021-11-01 10:02:25 +01:00
5756b5df33
upgrade major versions due to changes in basis and ECP formats
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needed to indicate that the backward copatibility will be broken
2021-10-19 10:24:44 +02:00
2bdcf87a55
Fix #62 : raise autoconf error when not in developer mode
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but trying to configure the GitHub repo clone.
This is required because TREXIO source files can either be generated in developer mode (using emacs org-mode files) or obtained from the source code distribution.
2021-10-12 15:55:58 +02:00
a8bdb9b00e
update current version to 1.1
2021-10-08 13:03:35 +02:00
947a8a12f8
Fix bug due to PACKAGE_VERSION definition in trexio.h
2021-10-07 09:54:19 +02:00
35cb07d11b
upgrade TREXIO major version before release
2021-09-30 17:26:58 +02:00
ed47bad056
roll back names in PKG_CHECK_MODULES
2021-08-21 11:58:42 +03:00
9f674b1add
fix bug due to HDF5 name duplication in PKG_CHECK_MODULES
2021-08-20 16:30:05 +03:00
aee68dd619
add Autoconf macro for SWIG
2021-08-20 15:20:09 +03:00
