a3fe

Contents:

  • Getting Started
  • a3fe Design
  • Guides
  • Warnings
  • Change Log
  • API Documentation
a3fe
  • Overview: module code

All modules for which code is available

  • a3fe.analyse.analyse_set
  • a3fe.analyse.compare
  • a3fe.analyse.detect_equil
  • a3fe.analyse.mbar
  • a3fe.analyse.plot
  • a3fe.analyse.rmsd
  • a3fe.analyse.waters
  • a3fe.configuration.engine_config
  • a3fe.configuration.slurm_config
  • a3fe.configuration.system_prep_config
  • a3fe.run._simulation_runner
  • a3fe.run._utils
  • a3fe.run._virtual_queue
  • a3fe.run.calc_set
  • a3fe.run.calculation
  • a3fe.run.lambda_window
  • a3fe.run.leg
  • a3fe.run.simulation
  • a3fe.run.stage
  • a3fe.run.system_prep

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