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Support custom non-bonded exceptions #105

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merged 8 commits into from
May 29, 2024

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SimonBoothroyd
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Description

This PR adds the ability to add custom exceptions (i.e. override mixing rules) to non-bonded potentials.

Status

  • Ready to go

@SimonBoothroyd SimonBoothroyd changed the title [WIP] Support custom non-bonded exceptions Support custom non-bonded exceptions May 28, 2024
@SimonBoothroyd SimonBoothroyd enabled auto-merge (squash) May 29, 2024 11:34
@SimonBoothroyd SimonBoothroyd merged commit b91eb59 into main May 29, 2024
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@SimonBoothroyd SimonBoothroyd deleted the sb/support-custom-exceptions branch May 29, 2024 11:36
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