Wheelodex » Projects » kimmdy

kimmdy

View on PyPI — Reverse Dependencies (1)

6.6.0 kimmdy-6.6.0-py3-none-any.whl

Wheel Details

Project: kimmdy
Version: 6.6.0
Filename: kimmdy-6.6.0-py3-none-any.whl
Download: [link]
Size: 96126
MD5: 3bcef8fbd8756f426c315aa65e6246b8
SHA256: 58b9e7a3069791b3220e1946ad3c64f5cbc929653de25e8e816dd98f43477ba0
Uploaded: 2024-04-26 07:59:20 +0000

dist-info

METADATA · WHEEL · RECORD · top_level.txt · entry_points.txt

METADATA

Metadata-Version: 2.1
Name: kimmdy
Version: 6.6.0
Summary: Kinetic Monte Carlo Molecular Dynamics
Author: hits-mbm
Author-Email: mbm[at]h-its.org
License: MIT
Classifier: Programming Language :: Python :: 3
Classifier: License :: OSI Approved :: GNU General Public License (GPL)
Classifier: Operating System :: OS Independent
Requires-Python: >=3.10
Requires-Dist: dill
Requires-Dist: pyyaml
Requires-Dist: numpy
Requires-Dist: importlib-metadata
Requires-Dist: MDAnalysis
Requires-Dist: pandas; extra == "analysis"
Requires-Dist: matplotlib; extra == "analysis"
Requires-Dist: seaborn; extra == "analysis"
Requires-Dist: pytest; extra == "dev"
Requires-Dist: tox; extra == "dev"
Requires-Dist: black; extra == "dev"
Requires-Dist: hypothesis; extra == "dev"
Requires-Dist: jupyter; extra == "dev"
Requires-Dist: quartodoc; extra == "dev"
Requires-Dist: pycallgraph2; extra == "dev"
Requires-Dist: kimmdy-reactions; extra == "dev"
Requires-Dist: kimmdy-grappa; extra == "dev"
Requires-Dist: pandas; extra == "dev"
Requires-Dist: matplotlib; extra == "dev"
Requires-Dist: seaborn; extra == "dev"
Requires-Dist: kimmdy-grappa; extra == "grappa"
Requires-Dist: kimmdy-reactions; extra == "plugins"
Requires-Dist: kimmdy-grappa; extra == "plugins"
Requires-Dist: kimmdy-reactions; extra == "reactions"
Provides-Extra: analysis
Provides-Extra: dev
Provides-Extra: grappa
Provides-Extra: plugins
Provides-Extra: reactions
Description-Content-Type: text/markdown
License-File: LICENSE
[Description omitted; length: 2541 characters]

WHEEL

Wheel-Version: 1.0
Generator: bdist_wheel (0.43.0)
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

Path Digest Size
kimmdy/__init__.py sha256=9S1JoaCUsDRHAjXkCPIKGzJBJIVL4GzNiP3AmsaUtBQ 63
kimmdy/analysis.py sha256=gz2Ly9-A-0CRy_vF7mCy7sbgH7ac7fO8we0lu8JiBs4 27766
kimmdy/cmd.py sha256=yQUDXf-3mZKbBqeDxFdiLITLju7tqw-dN2WTiOpc-xE 9301
kimmdy/config.py sha256=G0yAit_AoEBsOTXmdM8f4OVp9KcFk6KDCprzwM5_xBo 15559
kimmdy/constants.py sha256=PfAEMYo4dvbRDYIrZ_GBKPnz1bQ2jro4QUnhUjQxVoc 2872
kimmdy/coordinates.py sha256=HHdQ9tXKLefwkec8iCCCGdwBGuWjFnR_KRrFkCzkbNk 19841
kimmdy/kimmdy-yaml-schema.json sha256=-8LSvZnUDRIY8OSw7_OmuRbWDuuoI6kZvvYlEyidjUY 11802
kimmdy/kmc.py sha256=UBaupqAJlezUAkzMX-WfAzXS2THPTI9eG1L0XxyWRDA 14530
kimmdy/parsing.py sha256=EwSoP5_sbfH6k9-SQ4_SKNhVCEsjnWFSUdMrNpf_LEA 20101
kimmdy/plugins.py sha256=_J7UN3n_RfO16Ln2l3aSajgM-8j0ShfrbrM3hFoaTZM 3447
kimmdy/py.typed sha256=sow9soTwP9T_gEAQSVh7Gb8855h04Nwmhs2We-JRgZM 7
kimmdy/recipe.py sha256=QtyysDwb_R-OJ_ZjFV-g0VVUTUbMq7osAWtTH_qrKgY 23277
kimmdy/runmanager.py sha256=g7TV5AfHjly-zuAXV01b4qga_P8PaY3c_fRv73keIXA 31991
kimmdy/schema.py sha256=XveMu42gTGdkqjB1jq5Qac3oIBSyGFW14Z2y2Fe2CIA 6283
kimmdy/tasks.py sha256=B_X98xqc3p9F3a4NjLRINgKLFhjQMIHYXQYhSVJWIAw 5780
kimmdy/tools.py sha256=d4nUjjSgfz7I9k0QzFF2lI0P4VkLDGOD634iaDDPgEs 13540
kimmdy/utils.py sha256=U9TVcLYwYgMXI4jQEphNbinWOrsP05AEZitwpVZQ_cA 15215
kimmdy/assets/templates.py sha256=CssrR4xW0uOXMv7_qxnzwx0VFrOO92idYTzHa4ZD2Rk 1103
kimmdy/topology/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
kimmdy/topology/atomic.py sha256=0M-CMHYMx8WqMkqy90aUgZ06wGvzsmTJlAQWLZwlJ_U 16604
kimmdy/topology/ff.py sha256=DY9VE0cxODmd3_dmms0bBjr2U3gzVJONq1e3zFZeubs 5168
kimmdy/topology/topology.py sha256=6EHFptfXM-6tRZyozpBPq0dgwIV4XJmPbTMMrszV0Eg 52687
kimmdy/topology/utils.py sha256=PY6nm57o404goVnjFmV-CxcAJMma6Hv_eRjygA5uJNM 14316
kimmdy-6.6.0.dist-info/LICENSE sha256=OXLcl0T2SZ8Pmy2_dmlvKuetivmyPd5m1q-Gyd-zaYY 35149
kimmdy-6.6.0.dist-info/METADATA sha256=VYUO_fr-N1lVL6QKm4XGZqNwPo5B_X7oX7r42UhfnWc 4036
kimmdy-6.6.0.dist-info/WHEEL sha256=GJ7t_kWBFywbagK5eo9IoUwLW6oyOeTKmQ-9iHFVNxQ 92
kimmdy-6.6.0.dist-info/entry_points.txt sha256=kprkEfZa5woc9-dBsGQslhV1a9k0sCmMOapC1YfDgdw 232
kimmdy-6.6.0.dist-info/top_level.txt sha256=XnLD4RIhAQpnLiSBwx1GiHi_vwtiub_M9tu7FervbHY 7
kimmdy-6.6.0.dist-info/RECORD — —

top_level.txt

kimmdy

entry_points.txt

[console_scripts]
kimmdy = kimmdy.cmd:entry_point_kimmdy
kimmdy-analysis = kimmdy.analysis:entry_point_analysis
kimmdy-build-examples = kimmdy.tools:entry_point_build_examples
kimmdy-modify-top = kimmdy.tools:entry_point_modify_top