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Published November 28, 2022 | Version v1
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Supporting Data for "Does a Machine-Learnt Potential Perform Better Than an Optimally Tuned Traditional Force Field? A Case Study on Fluorohydrins"

Authors/Creators

  • 1. University of Southampton

Contributors

  • 1. University of Southampton
  • 2. Astex
  • 3. AstraZeneca

Description

Supporting Data for "Does a Machine-Learnt Potential Perform Better Than an Optimally Tuned Traditional Force Field? A Case Study on Fluorohydrins"

Files

fluorohydrin_tri_mol_figure5.zip

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