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CMMRLab/Class2-xe

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Class2-xe molecular systems and code

This directory holds the molecular systems used to benchmark the Class2-xe potential.

Terms of use

  • You agree to acknowledge the use of the Class2-xe in any reports or publications of results obtained with the Class2-xe potenial by citing "Integrating complete bond dissociation in Class II force fields via a Morse bond and cross-term reformulation" at https://doi.org/10.26434/chemrxiv-2025-jjwck.

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