OpenMM Nonbonded Slicing

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Contents

• Overview
• Installation
  • conda-forge
  • PyPI
  • Building from source
  • Running the tests
• User Guide
  • Subsets, slices and scaling parameters
  • Capped Lennard-Jones potential
  • Energy parameter derivatives
  • Reciprocal-space force group and exclusion corrections
  • Inner force group for multiple time stepping
• Theory
  • Potential Energy Slicing
  • Sliced Background Energy
  • Sliced Reciprocal-Space Energy
  • Sliced PME Implementation
  • Inner Force Group Energy
• Performance
• Python API
  • SlicedNonbondedForce
• Contributing
  • Bug reports
  • Documentation improvements
  • Feature requests and feedback
  • Development
• Author
• Changelog
  • 0.5.0 (unreleased)
  • 0.4.0
  • 0.3.0
• References

Indices and tables

• Index

• Search Page