screamlab 0.1.0__py3-none-any.whl

screamlab-0.1.0.dist-info/METADATA

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+Metadata-Version: 2.4
+Name: screamlab
+Version: 0.1.0
+Summary: Package for reproducible evaluation of SCREAM-DNP data.
+Home-page: https://github.com/FlorianTaube/screamlab
+Author: Florian Taube
+Author-email: florian.taube@uni-rostock.de
+License: BSD
+Project-URL: Documentation, https://github.com/FlorianTaube/screamlab/docs
+Project-URL: Source, https://github.com/FlorianTaube/screamlab/screamlab
+Keywords: Buildup Time Calculator,NMR,DNP,SCREAM_DNP,TopspinExport
+Classifier: Programming Language :: Python :: 3
+Classifier: Programming Language :: Python :: 3.10
+Classifier: Programming Language :: Python :: 3.11
+Classifier: Programming Language :: Python :: 3.12
+Classifier: Programming Language :: Python :: 3.13
+Classifier: License :: OSI Approved :: BSD License
+Classifier: Operating System :: OS Independent
+Classifier: Intended Audience :: Science/Research
+Classifier: Development Status :: 4 - Beta
+Requires-Python: >=3.10
+Description-Content-Type: text/x-rst
+License-File: LICENSE
+Requires-Dist: matplotlib
+Requires-Dist: numpy
+Requires-Dist: lmfit
+Requires-Dist: scipy
+Requires-Dist: nmrglue
+Requires-Dist: pyDOE3
+Provides-Extra: dev
+Requires-Dist: prospector; extra == "dev"
+Requires-Dist: pyroma; extra == "dev"
+Requires-Dist: bandit; extra == "dev"
+Requires-Dist: black; extra == "dev"
+Requires-Dist: pymetacode; extra == "dev"
+Provides-Extra: docs
+Requires-Dist: sphinx; extra == "docs"
+Requires-Dist: sphinx-rtd-theme; extra == "docs"
+Requires-Dist: sphinx_multiversion; extra == "docs"
+Provides-Extra: deployment
+Requires-Dist: build; extra == "deployment"
+Requires-Dist: twine; extra == "deployment"
+Dynamic: author
+Dynamic: author-email
+Dynamic: classifier
+Dynamic: description
+Dynamic: description-content-type
+Dynamic: home-page
+Dynamic: keywords
+Dynamic: license
+Dynamic: license-file
+Dynamic: project-url
+Dynamic: provides-extra
+Dynamic: requires-dist
+Dynamic: requires-python
+Dynamic: summary
+
+=========
+screamlab
+=========
+
+Welcome! This is screamlab, a Python package for the evaluation of relaxation processes in multi-spin system observed by  SCREAM-DNP (Specific Cross Relaxation Enhancement by Active Motions under Dynamic Nuclear Polarization).
+
+
+Features
+========
+
+A list of features:
+
+* Spectral deconvolution with various possible lineshapes (Gaussian, Lorentzian, Voigtian)
+
+* Global fitting of spectra with consistent parameters
+
+* Subsequent fitting of peak areas over time with exponential or biexponential behavior, or involving Solomon equations for a more complex fitting.
+
+
+And to make it even more convenient for users and future-proof:
+
+* Open source project written in Python (>= 3.7)
+
+* High test coverage
+
+* Extensive user and API documentation
+
+
+
+License
+=======
+
+This program is free software: you can redistribute it and/or modify it under the terms of the **BSD License**. See the file ``LICENSE`` for more details.

screamlab-0.1.0.dist-info/RECORD

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screamlab-0.1.0.dist-info/WHEEL

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+Wheel-Version: 1.0
+Generator: setuptools (80.9.0)
+Root-Is-Purelib: true
+Tag: py3-none-any
+

screamlab-0.1.0.dist-info/licenses/LICENSE

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+Copyright (c) 2024 Florian Taube
+All rights reserved.
+
+Redistribution and use in source and binary forms, with or without
+modification, are permitted provided that the following conditions are met:
+
+1. Redistributions of source code must retain the above copyright notice,
+this list of conditions and the following disclaimer.
+
+2. Redistributions in binary form must reproduce the above copyright notice,
+this list of conditions and the following disclaimer in the documentation
+and/or other materials provided with the distribution.
+
+THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS"
+AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO,
+THE IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR
+PURPOSE ARE DISCLAIMED. IN NO EVENT SHALL THE COPYRIGHT HOLDER OR CONTRIBUTORS
+BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR
+CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT LIMITED TO, PROCUREMENT OF
+SUBSTITUTE GOODS OR SERVICES; LOSS OF USE, DATA, OR PROFITS; OR BUSINESS
+INTERRUPTION) HOWEVER CAUSED AND ON ANY THEORY OF LIABILITY, WHETHER IN
+CONTRACT, STRICT LIABILITY, OR TORT (INCLUDING NEGLIGENCE OR OTHERWISE)
+ARISING IN ANY WAY OUT OF THE USE OF THIS SOFTWARE, EVEN IF ADVISED OF THE
+POSSIBILITY OF SUCH DAMAGE.

screamlab-0.1.0.dist-info/top_level.txt

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+screamlab