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TsumiNa committed Mar 12, 2021
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2 changes: 1 addition & 1 deletion LICENSE
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Copyright (c) 2019 TsumiNa. All rights reserved.
Copyright (c) 2021 TsumiNa. All rights reserved.

Redistribution and use in source and binary forms, with or without
modification, are permitted provided that the following conditions are
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2 changes: 1 addition & 1 deletion docs/source/conf.py
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#!/usr/bin/env python3
# -*- coding: utf-8 -*-

# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion setup.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/contrib/descriptor/test_mordred.py
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# Copyright (c) 2019. TsumiNa. All rights reserved.
# Copyright (c) 2021. TsumiNa. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/datatools/test_dataset.py
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# Copyright (c) 2019. TsumiNa. All rights reserved.
# Copyright (c) 2021. TsumiNa. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/datatools/test_preset.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/datatools/test_scaler.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/datatools/test_splitter.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/descriptor/test_base_desc.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/descriptor/test_crystal_graph.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/descriptor/test_elemental.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/descriptor/test_fingerprint.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/descriptor/test_frozen_feature.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/descriptor/test_structures.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/inverse/test_base_inverse.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/inverse/test_iqspr.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/mdl/test_mdl.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/models/test_base_runner.py
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# Copyright (c) 2019. TsumiNa. All rights reserved.
# Copyright (c) 2021. TsumiNa. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/models/test_checker.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/models/test_extension.py
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# Copyright (c) 2019. TsumiNa. All rights reserved.
# Copyright (c) 2021. TsumiNa. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/models/test_sequential.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/models/test_trainer.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/models/test_utils.py
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# Copyright (c) 2019. TsumiNa. All rights reserved.
# Copyright (c) 2021. TsumiNa. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/utils/test_gadget.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/utils/test_parameter_gen.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion tests/utils/test_product.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/__doc__.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.
2 changes: 1 addition & 1 deletion xenonpy/__init__.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/__main__.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/_conf.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/contrib/__init__.py
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# Copyright (c) 2019. TsumiNa. All rights reserved.
# Copyright (c) 2021. TsumiNa. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/contrib/extend_descriptors/__init__.py
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# Copyright (c) 2019. stewu5. All rights reserved.
# Copyright (c) 2021. stewu5. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.
2 changes: 1 addition & 1 deletion xenonpy/contrib/extend_descriptors/descriptor/__init__.py
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# Copyright (c) 2019. stewu5. All rights reserved.
# Copyright (c) 2021. stewu5. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/contrib/extend_descriptors/descriptor/frozen_featurizer_descriptor.py
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# Copyright (c) 2019. stewu5. All rights reserved.
# Copyright (c) 2021. stewu5. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/contrib/extend_descriptors/descriptor/mordred_descriptor.py
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# Copyright (c) 2019. stewu5. All rights reserved.
# Copyright (c) 2021. stewu5. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/contrib/extend_descriptors/descriptor/organic_comp_descriptor.py
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# Copyright (c) 2019. stewu5. All rights reserved.
# Copyright (c) 2021. stewu5. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.e

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2 changes: 1 addition & 1 deletion xenonpy/contrib/ismd/__init__.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/contrib/ismd/reactant_pool.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.
# -*- coding: utf-8 -*-
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2 changes: 1 addition & 1 deletion xenonpy/contrib/ismd/reactor.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/contrib/sample_codes/combine_fragments/combine_fragments.py
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# Copyright (c) 2019. stewu5. All rights reserved.
# Copyright (c) 2021. stewu5. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/datatools/__init__.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/datatools/dataset.py
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# Copyright (c) 2019. TsumiNa. All rights reserved.
# Copyright (c) 2021. TsumiNa. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/datatools/preset.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/datatools/splitter.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/datatools/transform.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/descriptor/__init__.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/descriptor/base.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/descriptor/cgcnn.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/descriptor/compositions.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/descriptor/fingerprint.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/descriptor/frozen_featurizer.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/descriptor/structure.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/inverse/__init__.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/inverse/base.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/inverse/iqspr/__init__.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/inverse/iqspr/estimator.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/inverse/iqspr/iqspr.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/inverse/iqspr/iqspr4df.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/inverse/iqspr/modifier.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/mdl/__init__.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/mdl/base.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/mdl/descriptor.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/mdl/mdl.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/mdl/method.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/mdl/model.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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2 changes: 1 addition & 1 deletion xenonpy/mdl/modelset.py
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# Copyright (c) 2019. yoshida-lab. All rights reserved.
# Copyright (c) 2021. yoshida-lab. All rights reserved.
# Use of this source code is governed by a BSD-style
# license that can be found in the LICENSE file.

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