Garleek
stable

User guide

  • Introduction
  • Installation
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Tutorials

  • A simple CH4 molecule
  • Organometallic species
  • Specific details for biomolecules
Garleek
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Index

B | F | G | P | R

B

  • backend_app() (in module garleek.cli)
  • backend_app_main() (in module garleek.cli)

F

  • frontend_app() (in module garleek.cli)
  • frontend_app_main() (in module garleek.cli)

G

  • garleek (module)
  • garleek.atom_types (module)
  • garleek.cli (module)
  • garleek.connectors (module)
  • garleek.mm (module)
  • garleek.mm.tinker (module)
  • garleek.qm (module)
  • garleek.qm.gaussian (module)
  • garleek.units (module)
  • gaussian_tinker() (in module garleek.connectors)
  • GaussianPatcher (class in garleek.qm.gaussian)
  • get_file() (in module garleek.atom_types)

P

  • parse() (in module garleek.atom_types)
  • parse_gaussian_EIn() (in module garleek.qm.gaussian)
  • patch() (garleek.qm.gaussian.GaussianPatcher method)
  • patch_gaussian_input() (in module garleek.qm.gaussian)
  • patch_tinker_output_for_inactive_atoms() (in module garleek.mm.tinker)
  • prepare_gaussian_EOu() (in module garleek.qm.gaussian)
  • prepare_tinker_key() (in module garleek.mm.tinker)
  • prepare_tinker_xyz() (in module garleek.mm.tinker)

R

  • run_tinker() (in module garleek.mm.tinker)

© Copyright 2018, Jaime Rodriguez-Guerra & Ignacio Funes-Ardoiz. Revision 8cf8f56c.

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