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Settles doesn't make edges #287

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fgrunewald opened this issue Dec 2, 2022 · 0 comments
Open

Settles doesn't make edges #287

fgrunewald opened this issue Dec 2, 2022 · 0 comments
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@fgrunewald
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Describe the bug
When running polyply gen_coords on settles molecules they are not connected, because the processor doesn't make bonds for settles molecules.

Expected behavior
Settles should make triangular bonds between the components.

Workaround
define a #FLEXIBLE directive

@fgrunewald fgrunewald added the bug Something isn't working label Dec 2, 2022
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