utilities
Helpful utilities used and exposed by the framework
Modules
Common exceptions raised by the framework. |
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Geometry centric functions such as computing pairwise distances |
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Load, manipulate and query OpenFF molecules |
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Common utilities and types for when building pydantic models. |
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Utilities for manipulating numpy and pytorch tensors using a consistent API. |
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Uniform API for performing common cheminformatics tasks / queries |