deeperwin
Introduction
DeepErwin Tutorial
Configuration Options
Full documentation for developers
deeperwin
deeperwin.checkpoints
deeperwin.cli
deeperwin.configuration
deeperwin.curvature_tags_and_blocks
deeperwin.evaluation
deeperwin.hamiltonian
deeperwin.local_features
deeperwin.loggers
deeperwin.mcmc
deeperwin.model
deeperwin.optimization
deeperwin.optimizers
deeperwin.orbitals
deeperwin.process_molecule
deeperwin.process_molecules_shared
deeperwin.run_tools
deeperwin.run_tools.available_gpus
deeperwin.run_tools.dispatch
deeperwin.run_tools.setup_calculations
deeperwin.run_tools.sweep_agent
deeperwin.utils
Indices and tables
deeperwin
»
Full documentation for developers
»
deeperwin
»
deeperwin.run_tools
»
deeperwin.run_tools.setup_calculations
»
deeperwin.run_tools.setup_calculations.setup_calculations
View page source
deeperwin.run_tools.setup_calculations.setup_calculations
deeperwin.run_tools.setup_calculations.
setup_calculations
(
args
)
[source]