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Published August 28, 2021 | Version 2021.8.28

SEAMM: Simulation Environment for Atomistic and Molecular Modeling

  • 1. Molecular Sciences Software Institute

Description

If an error occurs, the code tries to write out the current structures and print relevant information about the error before raising the error and exiting.

Notes

Funding: NSF OAC-1547580 and CHE-2136142

Files

molssi-seamm/seamm-2021.8.28.zip

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