THIRD PARTY NOTICES

This project incorporates components from the following third-party software:

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kallisto

Copyright 2021 Eike Caldeweyher
Developed by AstraZeneca
Authors: Eike Caldeweyher, Rocco Meli, Philipp Pracht

Licensed under the Apache License, Version 2.0 (the "License");
you may not use this file except in compliance with the License.
You may obtain a copy of the License at

    http://www.apache.org/licenses/LICENSE-2.0

Unless required by applicable law or agreed to in writing, software
distributed under the License is distributed on an "AS IS" BASIS,
WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
See the License for the specific language governing permissions and
limitations under the License.

The OEFP library's kallisto atom and bond descriptors port kallisto's
parameter tables and numeric methods. These are implemented in:
  - src/kallisto_data.cpp (ported parameter tables)
  - src/kallisto_descriptors.cpp (ported algorithms)
  - src/kallisto_geometry.cpp (ported geometry utilities)
  - tests/python/generate_kallisto_data.py (table generator)

kallisto is used as a test-time conformance oracle only and is not a
runtime dependency of OEFP.

For more information about kallisto, see:
https://github.com/AstraZeneca/kallisto

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