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DPGEN2
v0.0.5

User Guide

  • Command line interface
  • OP Configs

Developer Guide

  • Developers’ guide
  • Operators
  • Exploration
  • DPGEN2 API
DPGEN2
  • »
  • Overview: module code

All modules for which code is available

  • dpgen2.entrypoint.main
  • dpgen2.entrypoint.status
  • dpgen2.entrypoint.submit
  • dpgen2.exploration.report.naive_report
  • dpgen2.exploration.report.report
  • dpgen2.exploration.report.trajs_report
  • dpgen2.exploration.scheduler.convergence_check_stage_scheduler
  • dpgen2.exploration.scheduler.scheduler
  • dpgen2.exploration.scheduler.stage_scheduler
  • dpgen2.exploration.selector.conf_filter
  • dpgen2.exploration.selector.conf_selector
  • dpgen2.exploration.selector.conf_selector_frame
  • dpgen2.exploration.selector.trust_level
  • dpgen2.exploration.task.lmp.lmp_input
  • dpgen2.exploration.task.npt_task_group
  • dpgen2.exploration.task.stage
  • dpgen2.exploration.task.task
  • dpgen2.flow.dpgen_loop
  • dpgen2.fp.vasp
  • dpgen2.op.collect_data
  • dpgen2.op.md_settings
  • dpgen2.op.prep_dp_train
  • dpgen2.op.prep_lmp
  • dpgen2.op.prep_vasp
  • dpgen2.op.run_dp_train
  • dpgen2.op.run_lmp
  • dpgen2.op.run_vasp
  • dpgen2.op.select_confs
  • dpgen2.superop.block
  • dpgen2.superop.prep_run_dp_train
  • dpgen2.superop.prep_run_fp
  • dpgen2.superop.prep_run_lmp
  • dpgen2.utils.alloy_conf
  • dpgen2.utils.chdir
  • dpgen2.utils.dflow_config
  • dpgen2.utils.dflow_query
  • dpgen2.utils.obj_artifact
  • dpgen2.utils.run_command
  • dpgen2.utils.step_config
  • dpgen2.utils.unit_cells

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