mirror of
https://github.com/TREX-CoE/trexio.git
synced 2024-12-22 12:23:54 +01:00
Raise an error for unsafe dim arguments
This commit is contained in:
q-posev
parent
0bee7bb8d9
commit
005f9500d8
@ -100,6 +100,12 @@ module trexio
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This package is a top-level wrapper of the SWIG-generated pytrexio module.
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"""
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from os import path
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try:
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import numpy as np
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except ImportError:
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raise Exception("NumPy cannot be imported.")
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try:
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import pytrexio.pytrexio as pytr
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@ -110,7 +116,6 @@ except ImportError:
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PYTREXIO_MAX_STR_LENGTH = 2048
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# setuptools do not assign __version__ variable to the trexio package, so we set it manually
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from os import path
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__trexio_path__ = path.dirname(path.abspath(__file__))
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with open(path.join(path.join(__trexio_path__, 'pytrexio'), '_version.py')) as version_file:
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__version__ = version_file.read().split('"')[1]
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@ -2728,11 +2733,6 @@ def write_$group_dset$(trexio_file, dset_w) -> None:
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- Exception from some other error (e.g. RuntimeError).
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"""
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try:
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import numpy as np
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except ImportError:
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raise Exception("NumPy cannot be imported.")
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doConversion = False
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doFlatten = False
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if not isinstance(dset_w, (list, tuple)):
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@ -2801,24 +2801,24 @@ def read_$group_dset$(trexio_file, dim = None, doReshape = None, dtype = None):
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- Exception from some other error (e.g. RuntimeError).
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"""
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try:
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import numpy as np
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except ImportError:
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raise Exception("NumPy cannot be imported.")
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if doReshape is None:
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doReshape = True
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# if dim is not specified, read dimensions from the TREXIO file
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dims_list = None
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if dim is None or doReshape:
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if doReshape:
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$group_dset_dim$ = read_$group_dset_dim$(trexio_file)
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dims_list = [$group_dset_dim_list$]
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dim = 1
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dim_real = 1
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for i in range($group_dset_rank$):
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dim *= dims_list[i]
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dim_real *= dims_list[i]
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if dim:
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if dim_real != dim:
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raise Error(TREXIO_UNSAFE_ARRAY_DIM)
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else:
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dim = dim_real
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shape = tuple(dims_list)
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if shape is None and doReshape:
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@ -3348,11 +3348,6 @@ def write_$group_dset$(trexio_file: File, offset_file: int, buffer_size: int, in
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- Exception from some other error (e.g. RuntimeError).
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"""
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try:
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import numpy as np
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except ImportError:
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raise Exception("NumPy cannot be imported.")
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if not isinstance(offset_file, int):
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raise TypeError("offset_file argument has to be an integer.")
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if not isinstance(buffer_size, int):
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@ -3439,11 +3434,6 @@ def read_$group_dset$(trexio_file: File, offset_file: int, buffer_size: int) ->
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- Exception from some other error (e.g. RuntimeError).
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"""
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try:
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import numpy as np
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except ImportError:
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raise Exception("NumPy cannot be imported.")
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if not isinstance(offset_file, int):
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raise TypeError("offset_file argument has to be an integer.")
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if not isinstance(buffer_size, int):
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@ -3933,15 +3923,18 @@ def read_$group_dset$(trexio_file, dim = None) -> list:
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- Exception from some other error (e.g. RuntimeError).
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"""
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# if dim is not specified, read dimensions from the TREXIO file
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if dim is None:
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$group_dset_dim$ = read_$group_dset_dim$(trexio_file)
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dims_list = [$group_dset_dim_list$]
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dim = 1
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for i in range($group_dset_rank$):
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dim *= dims_list[i]
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$group_dset_dim$ = read_$group_dset_dim$(trexio_file)
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dims_list = [$group_dset_dim_list$]
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dim_real = 1
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for i in range($group_dset_rank$):
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dim_real *= dims_list[i]
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if dim:
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if dim_real != dim:
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raise Error(TREXIO_UNSAFE_ARRAY_DIM)
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else:
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dim = dim_real
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rc, dset_1d_r = pytr.trexio_read_$group_dset$_low(trexio_file.pytrexio_s, PYTREXIO_MAX_STR_LENGTH)
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if rc != TREXIO_SUCCESS:
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@ -4880,11 +4873,6 @@ def write_determinant_list(trexio_file: File, offset_file: int, buffer_size: int
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- Exception from some other error (e.g. RuntimeError).
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"""
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try:
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import numpy as np
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except ImportError:
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raise Exception("NumPy cannot be imported.")
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if not isinstance(offset_file, int):
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raise TypeError("offset_file argument has to be an integer.")
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if not isinstance(buffer_size, int):
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@ -4949,11 +4937,6 @@ def write_determinant_coefficient(trexio_file: File, offset_file: int, buffer_si
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- Exception from some other error (e.g. RuntimeError).
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"""
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try:
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import numpy as np
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except ImportError:
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raise Exception("NumPy cannot be imported.")
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if not isinstance(offset_file, int):
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raise TypeError("offset_file argument has to be an integer.")
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if not isinstance(buffer_size, int):
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@ -5000,11 +4983,6 @@ def read_determinant_list(trexio_file: File, offset_file: int, buffer_size: int)
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- Exception from some other error (e.g. RuntimeError).
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"""
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try:
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import numpy as np
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except ImportError:
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raise Exception("NumPy cannot be imported.")
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if not isinstance(offset_file, int):
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raise TypeError("offset_file argument has to be an integer.")
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if not isinstance(buffer_size, int):
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@ -5071,11 +5049,6 @@ def read_determinant_coefficient(trexio_file: File, offset_file: int, buffer_siz
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- Exception from some other error (e.g. RuntimeError).
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"""
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try:
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import numpy as np
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except ImportError:
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raise Exception("NumPy cannot be imported.")
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if not isinstance(offset_file, int):
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raise TypeError("offset_file argument has to be an integer.")
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if not isinstance(buffer_size, int):
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