diff --git a/gui/tests/env.js b/gui/tests/env.js index 9941d2c1f5384bf31d29767c463111922148c7e0..154dc77a392098069500102e63e4894ced9e9f37 100644 --- a/gui/tests/env.js +++ b/gui/tests/env.js @@ -2611,486 +2611,15 @@ window.nomadEnv = { }, "plugins": { "entry_points": { - "include": [ - "schema/simulation/run", - "schema/simulation/workflow", - "parsers/vasp" - ], "exclude": [ "nomad_porous_materials.normalizers:porositynormalizer" ], - "options": { - "normalizers/simulation/band_structure": { - "plugin_type": "normalizer", - "id": "normalizers/simulation/band_structure", - "name": "bandstructurenormalizer", - "description": "This is the normalizer for band structure in NOMAD.\n" - }, - "normalizers/simulation/dos": { - "plugin_type": "normalizer", - "id": "normalizers/simulation/dos", - "name": "dosnormalizer", - "description": "This is the normalizer for DOS in NOMAD.\n" - }, - "normalizers/simulation/soap": { - "plugin_type": "normalizer", - "id": "normalizers/simulation/soap", - "name": "soapnormalizer", - "description": "This is the normalizer for SOAP in NOMAD.\n" - }, - "normalizers/simulation/spectra": { - "plugin_type": "normalizer", - "id": "normalizers/simulation/spectra", - "name": "spectranormalizer", - "description": "This is the normalizer for spectra in NOMAD.\n" - }, - "normalizers/simulation/system": { - "plugin_type": "normalizer", - "id": "normalizers/simulation/system", - "name": "systemnormalizer", - "description": "This is the normalizer for system in NOMAD.\n" - }, - "normalizers/simulation/workflow": { - "plugin_type": "normalizer", - "id": "normalizers/simulation/workflow", - "name": "simulationworkflownormalizer", - "description": "This is the normalizer for simulation workflows in NOMAD.\n" - }, - "parsers/abacus": { - "plugin_type": "parser", - "id": "parsers/abacus", - "name": "parsers/abacus", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/abacus" - }, - "parsers/abinit": { - "plugin_type": "parser", - "id": "parsers/abinit", - "name": "parsers/abinit", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/abinit" - }, - "parsers/aflow": { - "plugin_type": "parser", - "id": "parsers/aflow", - "name": "parsers/aflow", - "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/aflow" - }, - "parsers/amber": { - "plugin_type": "parser", - "id": "parsers/amber", - "name": "parsers/amber", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/amber" - }, - "parsers/ams": { - "plugin_type": "parser", - "id": "parsers/ams", - "name": "parsers/ams", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/ams" - }, - "parsers/asap": { - "plugin_type": "parser", - "id": "parsers/asap", - "name": "parsers/asap", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/asap" - }, - "parsers/asr": { - "plugin_type": "parser", - "id": "parsers/asr", - "name": "parsers/asr", - "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/asr" - }, - "parsers/atk": { - "plugin_type": "parser", - "id": "parsers/atk", - "name": "parsers/atk", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/atk" - }, - "parsers/atomate": { - "plugin_type": "parser", - "id": "parsers/atomate", - "name": "parsers/atomate", - "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/automate" - }, - "parsers/bigdft": { - "plugin_type": "parser", - "id": "parsers/bigdft", - "name": "parsers/bigdft", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/bigdft" - }, - "parsers/bopfox": { - "plugin_type": "parser", - "id": "parsers/bopfox", - "name": "parsers/bopfox", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/bobfox" - }, - "parsers/castep": { - "plugin_type": "parser", - "id": "parsers/castep", - "name": "parsers/castep", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/castep" - }, - "parsers/charmm": { - "plugin_type": "parser", - "id": "parsers/charmm", - "name": "parsers/charmm", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/charmm" - }, - "parsers/chemotion/chemotion": { - "plugin_type": "parser", - "id": "parsers/chemotion/chemotion", - "name": "parsers/chemotion" - }, - "parsers/cp2k": { - "plugin_type": "parser", - "id": "parsers/cp2k", - "name": "parsers/cp2k", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/cp2k" - }, - "parsers/cpmd": { - "plugin_type": "parser", - "id": "parsers/cpmd", - "name": "parsers/cpmd", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/cpmd" - }, - "parsers/crystal": { - "plugin_type": "parser", - "id": "parsers/crystal", - "name": "parsers/crystal", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/crystal" - }, - "parsers/dftbplus": { - "plugin_type": "parser", - "id": "parsers/dftbplus", - "name": "parsers/dftbplus", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/dftplus" - }, - "parsers/dlpoly": { - "plugin_type": "parser", - "id": "parsers/dlpoly", - "name": "parsers/dl-poly", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/dlpoly" - }, - "parsers/dmol3": { - "plugin_type": "parser", - "id": "parsers/dmol3", - "name": "parsers/dmol", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/dmol3" - }, - "parsers/edmft": { - "plugin_type": "parser", - "id": "parsers/edmft", - "name": "parsers/edmft", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/edmft" - }, - "parsers/eelsdbparser": { - "plugin_type": "parser", - "id": "parsers/eelsdbparser", - "name": "parsers/eels", - "plugin_source_code_url": "https://github.com/nomad-coe/nomad-parser-eelsdb" - }, - "parsers/elabftw/elabftw": { - "plugin_type": "parser", - "id": "parsers/elabftw/elabftw", - "name": "parsers/elabftw", - "plugin_source_code_url": "https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/tree/develop/nomad/parsing/elabftw" - }, - "parsers/elastic": { - "plugin_type": "parser", - "id": "parsers/elastic", - "name": "parsers/elastic", - "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/elastic" - }, - "parsers/elk": { - "plugin_type": "parser", - "id": "parsers/elk", - "name": "parsers/elk", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/elk" - }, - "parsers/exciting": { - "plugin_type": "parser", - "id": "parsers/exciting", - "name": "parsers/exciting", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/exciting" - }, - "parsers/fhi-aims": { - "plugin_type": "parser", - "id": "parsers/fhi-aims", - "name": "parsers/fhi-aims", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/fhiaims" - }, - "parsers/fhivibes": { - "plugin_type": "parser", - "id": "parsers/fhivibes", - "name": "parsers/fhi-vibes", - "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/fhivibes" - }, - "parsers/fleur": { - "plugin_type": "parser", - "id": "parsers/fleur", - "name": "parsers/fleur", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/fleur" - }, - "parsers/fplo": { - "plugin_type": "parser", - "id": "parsers/fplo", - "name": "parsers/fplo", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/fplo" - }, - "parsers/gamess": { - "plugin_type": "parser", - "id": "parsers/gamess", - "name": "parsers/gamess", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/gamess" - }, - "parsers/gaussian": { - "plugin_type": "parser", - "id": "parsers/gaussian", - "name": "parsers/gaussian", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/gaussian" - }, - "parsers/gpaw": { - "plugin_type": "parser", - "id": "parsers/gpaw", - "name": "parsers/gpaw", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/gpaw" - }, - "parsers/gromacs": { - "plugin_type": "parser", - "id": "parsers/gromacs", - "name": "parsers/gromacs", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/gromacs" - }, - "parsers/gromos": { - "plugin_type": "parser", - "id": "parsers/gromos", - "name": "parsers/gromos", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/gromos" - }, - "parsers/gulp": { - "plugin_type": "parser", - "id": "parsers/gulp", - "name": "parsers/gulp", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/gulp" - }, - "parsers/h5md": { - "plugin_type": "parser", - "id": "parsers/h5md", - "name": "parsers/h5md" - }, - "parsers/lammps": { - "plugin_type": "parser", - "id": "parsers/lammps", - "name": "parsers/lammps", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/lammps" - }, - "parsers/libatoms": { - "plugin_type": "parser", - "id": "parsers/libatoms", - "name": "parsers/lib-atoms", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/libatoms" - }, - "parsers/lobster": { - "plugin_type": "parser", - "id": "parsers/lobster", - "name": "parsers/lobster", - "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/lobster" - }, - "parsers/magres": { - "plugin_type": "parser", - "id": "parsers/magres", - "name": "parsers/magres", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/magres" - }, - "parsers/molcas": { - "plugin_type": "parser", - "id": "parsers/molcas", - "name": "parsers/molcas", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/molcas" - }, - "parsers/mopac": { - "plugin_type": "parser", - "id": "parsers/mopac", - "name": "parsers/mopac", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/mopac" - }, - "parsers/namd": { - "plugin_type": "parser", - "id": "parsers/namd", - "name": "parsers/namd", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/namd" - }, - "parsers/nexus": { - "plugin_type": "parser", - "id": "parsers/nexus", - "name": "parsers/nexus", - "plugin_source_code_url": "https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/tree/develop/nomad/parsing/nexus" - }, - "parsers/nwchem": { - "plugin_type": "parser", - "id": "parsers/nwchem", - "name": "parsers/nwchem", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/nwchem" - }, - "parsers/ocean": { - "plugin_type": "parser", - "id": "parsers/ocean", - "name": "parsers/ocean", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/ocean" - }, - "parsers/octopus": { - "plugin_type": "parser", - "id": "parsers/octopus", - "name": "parsers/octopus", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/octopus" - }, - "parsers/onetep": { - "plugin_type": "parser", - "id": "parsers/onetep", - "name": "parsers/onetep", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/onetep" - }, - "parsers/openkim": { - "plugin_type": "parser", - "id": "parsers/openkim", - "name": "parsers/openkim", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/databaseparsers/openkim" - }, - "parsers/openmx": { - "plugin_type": "parser", - "id": "parsers/openmx", - "name": "parsers/openmx", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/openmx" - }, - "parsers/orca": { - "plugin_type": "parser", - "id": "parsers/orca", - "name": "parsers/orca", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/orca" - }, - "parsers/phonopy": { - "plugin_type": "parser", - "id": "parsers/phonopy", - "name": "parsers/phonopy", - "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/phonopy" - }, - "parsers/psi4": { - "plugin_type": "parser", - "id": "parsers/psi4", - "name": "parsers/psi4", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/psi4" - }, - "parsers/qball": { - "plugin_type": "parser", - "id": "parsers/qball", - "name": "parsers/qball", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/qball" - }, - "parsers/qbox": { - "plugin_type": "parser", - "id": "parsers/qbox", - "name": "parsers/qbox", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/qbox" - }, - "parsers/quantum_espresso_epw": { - "plugin_type": "parser", - "id": "parsers/quantum_espresso_epw", - "name": "parsers/quantumespressoepw", - "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/quantum_espresso_epw" - }, - "parsers/quantum_espresso_phonon": { - "plugin_type": "parser", - "id": "parsers/quantum_espresso_phonon", - "name": "parsers/quantumespressophonon", - "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/quantum_espresso_phonon" - }, - "parsers/quantum_espresso_xspectra": { - "plugin_type": "parser", - "id": "parsers/quantum_espresso_xspectra", - "name": "parsers/quantumespressoxspectra", - "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/quantum_espresso_xpectra" - }, - "parsers/quantumespresso": { - "plugin_type": "parser", - "id": "parsers/quantumespresso", - "name": "parsers/quantumespresso", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/quantumespresso" - }, - "parsers/siesta": { - "plugin_type": "parser", - "id": "parsers/siesta", - "name": "parsers/siesta", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/siesta" - }, - "parsers/soliddmft": { - "plugin_type": "parser", - "id": "parsers/soliddmft", - "name": "parsers/soliddmft", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/soliddmft" - }, - "parsers/tbstudio": { - "plugin_type": "parser", - "id": "parsers/tbstudio", - "name": "parsers/tbstudio" - }, - "parsers/tinker": { - "plugin_type": "parser", - "id": "parsers/tinker", - "name": "parsers/tinker", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/tinker" - }, - "parsers/turbomole": { - "plugin_type": "parser", - "id": "parsers/turbomole", - "name": "parsers/turbomole", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/turbomole" - }, - "parsers/vasp": { - "plugin_type": "parser", - "id": "parsers/vasp", - "name": "parsers/vasp", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/vasp" - }, - "parsers/w2dynamics": { - "plugin_type": "parser", - "id": "parsers/w2dynamics", - "name": "parsers/w2dynamics", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/w2dynamics" - }, - "parsers/wannier90": { - "plugin_type": "parser", - "id": "parsers/wannier90", - "name": "parsers/wannier90", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/wannier90" - }, - "parsers/wien2k": { - "plugin_type": "parser", - "id": "parsers/wien2k", - "name": "parsers/wien2k", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/wien2k" - }, - "parsers/xtb": { - "plugin_type": "parser", - "id": "parsers/xtb", - "name": "parsers/xtb", - "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/xtb" - }, - "parsers/yambo": { - "plugin_type": "parser", - "id": "parsers/yambo", - "name": "parsers/yambo", - "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/yambo" - }, - "schema/simulation/run": { - "plugin_type": "schema", - "id": "schema/simulation/run", - "name": "runschema", - "description": "Run schema plugin for NOMAD.\n" - }, - "schema/simulation/workflow": { - "plugin_type": "schema", - "id": "schema/simulation/workflow", - "name": "simulationworkflowschema", - "description": "This is a collection of schemas for various types of simulation workflows.\n" - }, + "include": [ + "schema/simulation/run", + "schema/simulation/workflow", + "parsers/vasp" + ], + "options": { "nomad_porous_materials.apps:mofapp": { "id": "nomad_porous_materials.apps:mofapp", "entry_point_type": "app", @@ -3517,19 +3046,471 @@ window.nomadEnv = { } } }, - "nomad_porous_materials.normalizers:porositynormalizer": { - "id": "nomad_porous_materials.normalizers:porositynormalizer", - "entry_point_type": "normalizer", - "name": "PorosityNormalizer", - "description": "\n Normalizer that automatically extracts properties from porous\n materials.\n ", - "plugin_package": "nomad_porous_materials" + "nomad_porous_materials.normalizers:porositynormalizer": { + "id": "nomad_porous_materials.normalizers:porositynormalizer", + "entry_point_type": "normalizer", + "name": "PorosityNormalizer", + "description": "\n Normalizer that automatically extracts properties from porous\n materials.\n ", + "plugin_package": "nomad_porous_materials" + }, + "normalizers/simulation/band_structure": { + "plugin_type": "normalizer", + "id": "normalizers/simulation/band_structure", + "name": "bandstructurenormalizer", + "description": "This is the normalizer for band structure in NOMAD.\n" + }, + "normalizers/simulation/dos": { + "plugin_type": "normalizer", + "id": "normalizers/simulation/dos", + "name": "dosnormalizer", + "description": "This is the normalizer for DOS in NOMAD.\n" + }, + "normalizers/simulation/soap": { + "plugin_type": "normalizer", + "id": "normalizers/simulation/soap", + "name": "soapnormalizer", + "description": "This is the normalizer for SOAP in NOMAD.\n" + }, + "normalizers/simulation/spectra": { + "plugin_type": "normalizer", + "id": "normalizers/simulation/spectra", + "name": "spectranormalizer", + "description": "This is the normalizer for spectra in NOMAD.\n" + }, + "normalizers/simulation/system": { + "plugin_type": "normalizer", + "id": "normalizers/simulation/system", + "name": "systemnormalizer", + "description": "This is the normalizer for system in NOMAD.\n" + }, + "normalizers/simulation/workflow": { + "plugin_type": "normalizer", + "id": "normalizers/simulation/workflow", + "name": "simulationworkflownormalizer", + "description": "This is the normalizer for simulation workflows in NOMAD.\n" + }, + "parsers/abacus": { + "plugin_type": "parser", + "id": "parsers/abacus", + "name": "parsers/abacus", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/abacus" + }, + "parsers/abinit": { + "plugin_type": "parser", + "id": "parsers/abinit", + "name": "parsers/abinit", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/abinit" + }, + "parsers/aflow": { + "plugin_type": "parser", + "id": "parsers/aflow", + "name": "parsers/aflow", + "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/aflow" + }, + "parsers/amber": { + "plugin_type": "parser", + "id": "parsers/amber", + "name": "parsers/amber", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/amber" + }, + "parsers/ams": { + "plugin_type": "parser", + "id": "parsers/ams", + "name": "parsers/ams", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/ams" + }, + "parsers/asap": { + "plugin_type": "parser", + "id": "parsers/asap", + "name": "parsers/asap", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/asap" + }, + "parsers/asr": { + "plugin_type": "parser", + "id": "parsers/asr", + "name": "parsers/asr", + "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/asr" + }, + "parsers/atk": { + "plugin_type": "parser", + "id": "parsers/atk", + "name": "parsers/atk", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/atk" + }, + "parsers/atomate": { + "plugin_type": "parser", + "id": "parsers/atomate", + "name": "parsers/atomate", + "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/automate" + }, + "parsers/bigdft": { + "plugin_type": "parser", + "id": "parsers/bigdft", + "name": "parsers/bigdft", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/bigdft" + }, + "parsers/bopfox": { + "plugin_type": "parser", + "id": "parsers/bopfox", + "name": "parsers/bopfox", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/bobfox" + }, + "parsers/castep": { + "plugin_type": "parser", + "id": "parsers/castep", + "name": "parsers/castep", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/castep" + }, + "parsers/charmm": { + "plugin_type": "parser", + "id": "parsers/charmm", + "name": "parsers/charmm", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/charmm" + }, + "parsers/chemotion/chemotion": { + "plugin_type": "parser", + "id": "parsers/chemotion/chemotion", + "name": "parsers/chemotion" + }, + "parsers/cp2k": { + "plugin_type": "parser", + "id": "parsers/cp2k", + "name": "parsers/cp2k", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/cp2k" + }, + "parsers/cpmd": { + "plugin_type": "parser", + "id": "parsers/cpmd", + "name": "parsers/cpmd", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/cpmd" + }, + "parsers/crystal": { + "plugin_type": "parser", + "id": "parsers/crystal", + "name": "parsers/crystal", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/crystal" + }, + "parsers/dftbplus": { + "plugin_type": "parser", + "id": "parsers/dftbplus", + "name": "parsers/dftbplus", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/dftplus" + }, + "parsers/dlpoly": { + "plugin_type": "parser", + "id": "parsers/dlpoly", + "name": "parsers/dl-poly", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/dlpoly" + }, + "parsers/dmol3": { + "plugin_type": "parser", + "id": "parsers/dmol3", + "name": "parsers/dmol", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/dmol3" + }, + "parsers/edmft": { + "plugin_type": "parser", + "id": "parsers/edmft", + "name": "parsers/edmft", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/edmft" + }, + "parsers/eelsdbparser": { + "plugin_type": "parser", + "id": "parsers/eelsdbparser", + "name": "parsers/eels", + "plugin_source_code_url": "https://github.com/nomad-coe/nomad-parser-eelsdb" + }, + "parsers/elabftw/elabftw": { + "plugin_type": "parser", + "id": "parsers/elabftw/elabftw", + "name": "parsers/elabftw", + "plugin_source_code_url": "https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/tree/develop/nomad/parsing/elabftw" + }, + "parsers/elastic": { + "plugin_type": "parser", + "id": "parsers/elastic", + "name": "parsers/elastic", + "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/elastic" + }, + "parsers/elk": { + "plugin_type": "parser", + "id": "parsers/elk", + "name": "parsers/elk", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/elk" + }, + "parsers/exciting": { + "plugin_type": "parser", + "id": "parsers/exciting", + "name": "parsers/exciting", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/exciting" + }, + "parsers/fhi-aims": { + "plugin_type": "parser", + "id": "parsers/fhi-aims", + "name": "parsers/fhi-aims", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/fhiaims" + }, + "parsers/fhivibes": { + "plugin_type": "parser", + "id": "parsers/fhivibes", + "name": "parsers/fhi-vibes", + "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/fhivibes" + }, + "parsers/fleur": { + "plugin_type": "parser", + "id": "parsers/fleur", + "name": "parsers/fleur", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/fleur" + }, + "parsers/fplo": { + "plugin_type": "parser", + "id": "parsers/fplo", + "name": "parsers/fplo", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/fplo" + }, + "parsers/gamess": { + "plugin_type": "parser", + "id": "parsers/gamess", + "name": "parsers/gamess", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/gamess" + }, + "parsers/gaussian": { + "plugin_type": "parser", + "id": "parsers/gaussian", + "name": "parsers/gaussian", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/gaussian" + }, + "parsers/gpaw": { + "plugin_type": "parser", + "id": "parsers/gpaw", + "name": "parsers/gpaw", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/gpaw" + }, + "parsers/gromacs": { + "plugin_type": "parser", + "id": "parsers/gromacs", + "name": "parsers/gromacs", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/gromacs" + }, + "parsers/gromos": { + "plugin_type": "parser", + "id": "parsers/gromos", + "name": "parsers/gromos", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/gromos" + }, + "parsers/gulp": { + "plugin_type": "parser", + "id": "parsers/gulp", + "name": "parsers/gulp", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/gulp" + }, + "parsers/h5md": { + "plugin_type": "parser", + "id": "parsers/h5md", + "name": "parsers/h5md" }, - "perovskite_solar_cell_database:perovskite_solar_cell": { - "id": "perovskite_solar_cell_database:perovskite_solar_cell", - "entry_point_type": "schema_package", - "name": "PerovskiteSolarCell", - "description": "Schema package defined for the perovskite solar cells database.", - "plugin_package": "perovskite_solar_cell_database" + "parsers/lammps": { + "plugin_type": "parser", + "id": "parsers/lammps", + "name": "parsers/lammps", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/lammps" + }, + "parsers/libatoms": { + "plugin_type": "parser", + "id": "parsers/libatoms", + "name": "parsers/lib-atoms", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/libatoms" + }, + "parsers/lobster": { + "plugin_type": "parser", + "id": "parsers/lobster", + "name": "parsers/lobster", + "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/lobster" + }, + "parsers/magres": { + "plugin_type": "parser", + "id": "parsers/magres", + "name": "parsers/magres", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/magres" + }, + "parsers/molcas": { + "plugin_type": "parser", + "id": "parsers/molcas", + "name": "parsers/molcas", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/molcas" + }, + "parsers/mopac": { + "plugin_type": "parser", + "id": "parsers/mopac", + "name": "parsers/mopac", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/mopac" + }, + "parsers/namd": { + "plugin_type": "parser", + "id": "parsers/namd", + "name": "parsers/namd", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/namd" + }, + "parsers/nexus": { + "plugin_type": "parser", + "id": "parsers/nexus", + "name": "parsers/nexus", + "plugin_source_code_url": "https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/tree/develop/nomad/parsing/nexus" + }, + "parsers/nwchem": { + "plugin_type": "parser", + "id": "parsers/nwchem", + "name": "parsers/nwchem", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/nwchem" + }, + "parsers/ocean": { + "plugin_type": "parser", + "id": "parsers/ocean", + "name": "parsers/ocean", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/ocean" + }, + "parsers/octopus": { + "plugin_type": "parser", + "id": "parsers/octopus", + "name": "parsers/octopus", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/octopus" + }, + "parsers/onetep": { + "plugin_type": "parser", + "id": "parsers/onetep", + "name": "parsers/onetep", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/onetep" + }, + "parsers/openkim": { + "plugin_type": "parser", + "id": "parsers/openkim", + "name": "parsers/openkim", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/databaseparsers/openkim" + }, + "parsers/openmx": { + "plugin_type": "parser", + "id": "parsers/openmx", + "name": "parsers/openmx", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/openmx" + }, + "parsers/orca": { + "plugin_type": "parser", + "id": "parsers/orca", + "name": "parsers/orca", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/orca" + }, + "parsers/phonopy": { + "plugin_type": "parser", + "id": "parsers/phonopy", + "name": "parsers/phonopy", + "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/phonopy" + }, + "parsers/psi4": { + "plugin_type": "parser", + "id": "parsers/psi4", + "name": "parsers/psi4", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/psi4" + }, + "parsers/qball": { + "plugin_type": "parser", + "id": "parsers/qball", + "name": "parsers/qball", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/qball" + }, + "parsers/qbox": { + "plugin_type": "parser", + "id": "parsers/qbox", + "name": "parsers/qbox", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/qbox" + }, + "parsers/quantum_espresso_epw": { + "plugin_type": "parser", + "id": "parsers/quantum_espresso_epw", + "name": "parsers/quantumespressoepw", + "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/quantum_espresso_epw" + }, + "parsers/quantum_espresso_phonon": { + "plugin_type": "parser", + "id": "parsers/quantum_espresso_phonon", + "name": "parsers/quantumespressophonon", + "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/quantum_espresso_phonon" + }, + "parsers/quantum_espresso_xspectra": { + "plugin_type": "parser", + "id": "parsers/quantum_espresso_xspectra", + "name": "parsers/quantumespressoxspectra", + "plugin_source_code_url": "https://github.com/nomad-coe/workflow-parsers/tree/master/workflowparsers/quantum_espresso_xpectra" + }, + "parsers/quantumespresso": { + "plugin_type": "parser", + "id": "parsers/quantumespresso", + "name": "parsers/quantumespresso", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/quantumespresso" + }, + "parsers/siesta": { + "plugin_type": "parser", + "id": "parsers/siesta", + "name": "parsers/siesta", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/siesta" + }, + "parsers/soliddmft": { + "plugin_type": "parser", + "id": "parsers/soliddmft", + "name": "parsers/soliddmft", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/soliddmft" + }, + "parsers/tbstudio": { + "plugin_type": "parser", + "id": "parsers/tbstudio", + "name": "parsers/tbstudio" + }, + "parsers/tinker": { + "plugin_type": "parser", + "id": "parsers/tinker", + "name": "parsers/tinker", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/tinker" + }, + "parsers/turbomole": { + "plugin_type": "parser", + "id": "parsers/turbomole", + "name": "parsers/turbomole", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/turbomole" + }, + "parsers/vasp": { + "plugin_type": "parser", + "id": "parsers/vasp", + "name": "parsers/vasp", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/vasp" + }, + "parsers/w2dynamics": { + "plugin_type": "parser", + "id": "parsers/w2dynamics", + "name": "parsers/w2dynamics", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/w2dynamics" + }, + "parsers/wannier90": { + "plugin_type": "parser", + "id": "parsers/wannier90", + "name": "parsers/wannier90", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/wannier90" + }, + "parsers/wien2k": { + "plugin_type": "parser", + "id": "parsers/wien2k", + "name": "parsers/wien2k", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/wien2k" + }, + "parsers/xtb": { + "plugin_type": "parser", + "id": "parsers/xtb", + "name": "parsers/xtb", + "plugin_source_code_url": "https://github.com/nomad-coe/atomistic-parsers/tree/develop/atomisticparsers/xtb" + }, + "parsers/yambo": { + "plugin_type": "parser", + "id": "parsers/yambo", + "name": "parsers/yambo", + "plugin_source_code_url": "https://github.com/nomad-coe/electronic-parsers/tree/develop/electronicparsers/yambo" }, "perovskite_solar_cell_database.apps:solar_cells": { "id": "perovskite_solar_cell_database.apps:solar_cells", @@ -4208,33 +4189,52 @@ window.nomadEnv = { ] } } + }, + "perovskite_solar_cell_database:perovskite_solar_cell": { + "id": "perovskite_solar_cell_database:perovskite_solar_cell", + "entry_point_type": "schema_package", + "name": "PerovskiteSolarCell", + "description": "Schema package defined for the perovskite solar cells database.", + "plugin_package": "perovskite_solar_cell_database" + }, + "schema/simulation/run": { + "plugin_type": "schema", + "id": "schema/simulation/run", + "name": "runschema", + "description": "Run schema plugin for NOMAD.\n" + }, + "schema/simulation/workflow": { + "plugin_type": "schema", + "id": "schema/simulation/workflow", + "name": "simulationworkflowschema", + "description": "This is a collection of schemas for various types of simulation workflows.\n" } } }, "plugin_packages": { "nomad_porous_materials": { - "name": "nomad_porous_materials", "description": "NOMAD plugin for porous materials", - "version": "0.1.0", - "homepage": null, "documentation": null, - "repository": "https://github.com/lauri-codes/nomad-porous-materials", "entry_points": [ "nomad_porous_materials.apps:mofapp", "nomad_porous_materials.normalizers:porositynormalizer" - ] + ], + "homepage": null, + "name": "nomad_porous_materials", + "repository": "https://github.com/lauri-codes/nomad-porous-materials", + "version": "0.1.0" }, "perovskite_solar_cell_database": { - "name": "perovskite_solar_cell_database", "description": "Perovskite solar cell data schema plugin for NOMAD.", - "version": "0.0.0", - "homepage": "https://github.com/FAIRmat-NFDI/nomad-perovskite-solar-cells-database", "documentation": null, - "repository": "https://github.com/FAIRmat-NFDI/nomad-perovskite-solar-cells-database", "entry_points": [ "perovskite_solar_cell_database:perovskite_solar_cell", "perovskite_solar_cell_database.apps:solar_cells" - ] + ], + "homepage": "https://github.com/FAIRmat-NFDI/nomad-perovskite-solar-cells-database", + "name": "perovskite_solar_cell_database", + "repository": "https://github.com/FAIRmat-NFDI/nomad-perovskite-solar-cells-database", + "version": "0.0.0" } } } diff --git a/nomad/cli/dev.py b/nomad/cli/dev.py index 7c7db7a37f4e6b8d2556e0920a694ddf461634de..fc26cfc4235469886cc451c5f9653db2f494facb 100644 --- a/nomad/cli/dev.py +++ b/nomad/cli/dev.py @@ -218,8 +218,15 @@ def get_gui_config() -> str: """ from nomad.config import config + def _sort_dict(d): + if isinstance(d, dict): + return {k: _sort_dict(v) for k, v in sorted(d.items())} + if isinstance(d, list): + return [_sort_dict(v) for v in d] + return d + config.load_plugins() - plugins = config.plugins.dict(exclude_unset=True) + plugins = _sort_dict(config.plugins.dict(exclude_unset=True)) for key in plugins['entry_points']['options'].keys(): plugins['entry_points']['options'][key] = config.plugins.entry_points.options[ key diff --git a/scripts/check_gui_artifacts.sh b/scripts/check_gui_artifacts.sh index 5ca49ab3b70c9f97950ae602c891a5e6ae071788..0de3ca8b2646fff844cf1c7c70edc966358a33d0 100755 --- a/scripts/check_gui_artifacts.sh +++ b/scripts/check_gui_artifacts.sh @@ -14,10 +14,6 @@ mkdir tmp NOMAD_CONFIG=gui/tests/nomad.yaml python -m nomad.cli dev gui-artifacts > tmp/artifacts.js NOMAD_CONFIG=gui/tests/nomad.yaml python -m nomad.cli dev gui-config > tmp/env.js -diff gui/tests/artifacts.js tmp/artifacts.js -diff gui/tests/env.js tmp/env.js - -# cleanup +diff gui/tests/artifacts.js tmp/artifacts.js; \ +diff gui/tests/env.js tmp/env.js; \ rm -rf tmp - -