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lindemann

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0.10.0 lindemann-0.10.0-py3-none-any.whl

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Project: lindemann
Version: 0.10.0
Filename: lindemann-0.10.0-py3-none-any.whl
Download: [link]
Size: 32713
MD5: 3f64e21c8b7a3b6f28a6e4fcff167488
SHA256: 61ef3b8df69db9dd6ce9b5073973de53e3de4670c90541a474267773da51a32a
Uploaded: 2024-06-11 22:43:31 +0000

dist-info

METADATA · WHEEL · RECORD · entry_points.txt

METADATA

Metadata-Version: 2.1
Name: lindemann
Version: 0.10.0
Summary: lindemann is a python package to calculate the Lindemann index of a lammps trajectory as well as the progression of the Lindemann index per frame of temperature ramps for phase transition analysis.
Author: N720720
Author-Email: s.thurm[at]protonmail.com
Home-Page: https://github.com/N720720/lindemann
Project-Url: Repository, https://github.com/N720720/lindemann
License: GPL-3.0-or-later
Keywords: Molecular Dynamics,Cheminformatics,Lindemann,Lindemann Index,Cheminformatics,Phase transition
Classifier: Development Status :: 4 - Beta
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved :: GNU General Public License v3 or later (GPLv3+)
Classifier: Operating System :: MacOS :: MacOS X
Classifier: Operating System :: Microsoft :: Windows
Classifier: Operating System :: POSIX :: Linux
Classifier: Programming Language :: Python :: 3
Classifier: Programming Language :: Python :: 3.9
Classifier: Programming Language :: Python :: 3.10
Classifier: Programming Language :: Python :: 3.11
Classifier: Topic :: Scientific/Engineering :: Bio-Informatics
Classifier: Topic :: Scientific/Engineering :: Chemistry
Classifier: Topic :: Scientific/Engineering :: Physics
Requires-Python: >=3.9,<3.12
Requires-Dist: importlib-metadata (<8.0.0,>=7.1.0)
Requires-Dist: intel-cmplr-lib-rt (<2025.0.0,>=2024.1.2); sys_platform == "linux"
Requires-Dist: intel-cmplr-lib-rt (<2025.0.0,>=2024.1.2); sys_platform == "win32"
Requires-Dist: matplotlib (<4.0.0,>=3.9.0)
Requires-Dist: numba (<0.60.0,>=0.59.1)
Requires-Dist: numpy (<2.0.0,>=1.26.4)
Requires-Dist: ovito (<4.0.0,>=3.10.6)
Requires-Dist: pathlib (<2.0.0,>=1.0.1)
Requires-Dist: psutil (<6.0.0,>=5.9.8)
Requires-Dist: rich (<14.0.0,>=13.7.1)
Requires-Dist: typer (<0.13.0,>=0.12.3)
Description-Content-Type: text/markdown
[Description omitted; length: 13162 characters]

WHEEL

Wheel-Version: 1.0
Generator: poetry-core 1.8.1
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

Path Digest Size
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lindemann/__main__.py sha256=u_n1Rk3RVshLMw2e0thtS1p_l4oucdesNXQrbZ5zPGk 66
lindemann/index/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
lindemann/index/mem_use.py sha256=Xvr3MkEgTCpdM-kEYRFFI8o34iAq3RDv4zQiEdAyM0E 1905
lindemann/index/online_atoms.py sha256=zo9ZGRc1MijlwZkOosI3VM22G2pT9ghh8ZACxTIQilY 3510
lindemann/index/online_frames.py sha256=01Fi2W0luDn8b1zQpFkXva-PsFecPNjtydd6_8WAbEc 3012
lindemann/index/online_trj.py sha256=orWRU3gFuf--gJ1II-F6j7NtzsBlzfm5hLclBc4D5OU 2865
lindemann/index/parallel_trj.py sha256=qg965ScEEftl1yp5_Y1l2muOMrhv8n2JQqnfWQ2u1j0 4675
lindemann/index/per_atoms.py sha256=OfiXTzvHAY-n4w-3Hcmp4PvEGlt0Qi_uA5k3pT5PoJk 2039
lindemann/index/per_frames.py sha256=GGmlLjNsaxsen2OwwSkw3r5Br-S8VdkcGKlbFZxDrh8 1464
lindemann/index/per_trj.py sha256=JNtglBJ1noKw37U2qkGmSVvNLaLz4t9DKemUl2YOSZQ 3727
lindemann/main.py sha256=qJV9ZS8rKKvmAFtsrh8MDn3HRJtSerNF_UwFrpJGNBc 8643
lindemann/py.typed sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
lindemann/trajectory/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
lindemann/trajectory/plt_plot.py sha256=RBv_jpG0X49hqQ2ynGVLir7XHCdJ9u0ZARsAicbeCBs 482
lindemann/trajectory/read.py sha256=q42Gnb0ROB5HI2_25Mk-c_ro6UwM6jXI7eia6KmdYh0 2601
lindemann/trajectory/save.py sha256=d72fpxTDZHU69FOPLeCPcmlJry4lE1YJpLX0af6KhwM 1686
lindemann-0.10.0.dist-info/LICENSE sha256=OXLcl0T2SZ8Pmy2_dmlvKuetivmyPd5m1q-Gyd-zaYY 35149
lindemann-0.10.0.dist-info/METADATA sha256=Tdzvm5rchZVSyPgrhAJqrxIFOXVeMakD3zlXBSnl0Pg 15037
lindemann-0.10.0.dist-info/WHEEL sha256=FMvqSimYX_P7y0a7UY-_Mc83r5zkBZsCYPm7Lr0Bsq4 88
lindemann-0.10.0.dist-info/entry_points.txt sha256=5KzA7BKJk-JDPDq5Lzu7OZ0xbep-ap48kOAk-TAwFkg 48
lindemann-0.10.0.dist-info/RECORD — —

entry_points.txt

[console_scripts]
lindemann = lindemann.main:app