|
|
246847b8d5
|
Merge branch 'master' into add-auto-backend
|
2022-01-25 16:24:34 +01:00 |
|
|
|
d9309f5ab2
|
modify some tests to use TREXIO_AUTO back end
|
2022-01-25 15:00:55 +01:00 |
|
|
|
8947f6caa7
|
Merge branch 'master' into add-unsafe-open-mode
|
2022-01-24 18:25:52 +01:00 |
|
|
|
6ac4e0c761
|
add tests for the unsafe mode in the Python API
|
2022-01-24 16:29:40 +01:00 |
|
|
|
5e82e0fc57
|
add tests for trexio_info
|
2022-01-20 14:22:32 +01:00 |
|
|
|
e9db0c66d4
|
add tests
|
2022-01-19 14:08:38 +01:00 |
|
|
|
0cadb4ea0b
|
add the tests for the top-level Python API of sparse data
|
2021-12-27 14:02:58 +01:00 |
|
|
|
c92cae947f
|
[WIP] adapt the test of the low-level (pytrexio) API for sparse data
|
2021-12-24 11:51:06 +01:00 |
|
|
|
72897e4b5d
|
[WIP] read/write of sparse data in Python
|
2021-12-23 18:27:24 +01:00 |
|
|
|
6cf6121f50
|
fix pytrexio test
|
2021-11-02 10:30:35 +01:00 |
|
|
|
7459589701
|
adapt the tests to use basis_shell_num
|
2021-10-21 15:52:12 +02:00 |
|
|
|
64b3e25da5
|
fix Python tests for basis_nucleus_index
|
2021-10-19 10:43:00 +02:00 |
|
|
|
67b00efa9c
|
handle return error of trexio_open in the Python API
|
2021-09-22 16:40:55 +02:00 |
|
|
|
1589995775
|
do not use warnings for an attempt to overwrite in the Python API
|
2021-09-13 11:46:31 +02:00 |
|
|
|
2bd4ef9bfd
|
add has_ functions to the Python API
|
2021-09-13 11:29:00 +02:00 |
|
|
|
77e3f1ac11
|
print UserWarning instead of raising Error for an attempt to overwrite data
following suggestion of Vijay G.C.
|
2021-09-12 14:24:50 +02:00 |
|
|
|
96678fea2e
|
adapt write functions to receive multidimensional arrays or lists
|
2021-09-07 17:14:23 +02:00 |
|
|
|
ced8210ff0
|
BUG: trexio_open fails when test script is executed from outside the root test directory
|
2021-08-30 18:23:24 +03:00 |
|
|
|
5a2b4d96a7
|
reshape output arrays by default when reading from the file
|
2021-08-27 16:08:39 +03:00 |
|
|
|
7b5ebf6272
|
implement TREXIO File class and change import of pytrexio module
|
2021-08-26 17:01:53 +03:00 |
|
|
|
4c28a4cac8
|
add type converters for numerical arrays in read/write Python functions
|
2021-08-26 13:14:46 +03:00 |
|
|
|
2911e91941
|
make dim an optional argument in read_ functions
if dim is None - the function read all necessary dimensions from the TREXIO file
|
2021-08-24 12:51:43 +03:00 |
|
|
|
f30c6f60a6
|
document test_api file
|
2021-08-21 13:14:59 +03:00 |
|
|
|
5d5025ae1d
|
get rid of _safe suffix and add dimension to read_dset_str functions
|
2021-08-20 13:43:15 +03:00 |
|
|
|
8d8658fabf
|
minor cleaning + exception handling for an unsafe call to the safe API
|
2021-08-18 15:42:10 +03:00 |
|
|
|
cb1e83ca57
|
adapt tests to check both pytrexio and trexio_api modules
|
2021-08-18 13:40:27 +03:00 |
|
|
|
808adc7cd8
|
add typemaps and tests for numpy int arrays
+ some cleaning in the Python test and SWIG interface files
|
2021-08-06 14:04:29 +03:00 |
|
|
|
2854d617d4
|
make python directory and adapt build process
|
2021-08-05 12:55:18 +03:00 |
|
