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Update eann.py #170

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Update eann.py #170

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[Enhancement] Improved EANN Model with Hard Cutoff for Efficient Interaction Handling

  • Enabled hard cutoff in EANN model, aligning with cutoff rules in XML file.
  • Allows processing of larger atom pairs, minimizing unnecessary interaction counts.

[Enhancement] Improved EANN Model with Hard Cutoff for Efficient Interaction Handling

- Enabled hard cutoff in EANN model, aligning with cutoff rules in XML file.
- Allows processing of larger atom pairs, minimizing unnecessary interaction counts.
@junminchen junminchen closed this Apr 6, 2024
@junminchen junminchen deleted the patch-2 branch April 7, 2024 04:55
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