mdsuite.utils.exceptions module

MDSuite: A Zincwarecode package.

License

This program and the accompanying materials are made available under the terms of the Eclipse Public License v2.0 which accompanies this distribution, and is available at https://www.eclipse.org/legal/epl-v20.html

SPDX-License-Identifier: EPL-2.0

Copyright Contributors to the Zincwarecode Project.

Contact Information

email: zincwarecode@gmail.com github: https://github.com/zincware web: https://zincwarecode.com/

Citation

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Summary

exception mdsuite.utils.exceptions.CannotPerformThisAnalysis

Bases: Exception

Thrown when analysis cannot be reliably performed given the tensor_values.

exception mdsuite.utils.exceptions.DatabaseDoesNotExist

Bases: Exception

Thrown when a preexisting database_path object is called but none exists.

exception mdsuite.utils.exceptions.DatasetExists

Bases: Exception

Thrown if a dataset in a hdf5 database_path already exists.

exception mdsuite.utils.exceptions.ElementMassAssignedZero

Bases: Exception

Thrown when an element mass has been assigned zero.

exception mdsuite.utils.exceptions.NoElementInDump

Bases: Exception

Thrown when no elements are found in a dump file.

exception mdsuite.utils.exceptions.NoGPUInSystem

Bases: Exception

Thrown during experiment analysis when GPUs are being searched for.

exception mdsuite.utils.exceptions.NoTempInData

Bases: Exception

Thrown when no temperature is found in a tensor_values file.

exception mdsuite.utils.exceptions.NotApplicableToAnalysis

Bases: Exception

Thrown when the function is not applicable to the type of analysis.

exception mdsuite.utils.exceptions.NotInDataFile

Bases: Exception

Thrown when a parameter is not in a data file.

exception mdsuite.utils.exceptions.RangeExceeded

Bases: Exception

Thrown when the tensor_values range asked for exceeds the total number of configurations.