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Bumped version number.
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sametz committed Mar 29, 2020
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6 changes: 3 additions & 3 deletions CHANGELOG.rst
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Expand Up @@ -37,8 +37,8 @@ the author interprets the terms below as follows:
API is stable.
The package is available on PyPI (and perhaps conda).

x.y.z - 2020-xx-xx (dev)
------------------------
0.5.0 - 2020-03-29 (beta release)
---------------------------------
Changed
^^^^^^^
* add_lorentzians moved from nmr.plt to nmr.math.
Expand All @@ -52,7 +52,7 @@ Changed
if tkinter is not found on the users system, and print a warning message
that plots will not be visible.

0.4.0 - 2020-xx-xx (beta release)
0.4.0 - 2020-02-22 (beta release)
---------------------------------
Changed
^^^^^^^
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2 changes: 1 addition & 1 deletion README.rst
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Expand Up @@ -5,7 +5,7 @@ Click the "**Launch Binder**" link above to see how **nmrsim** can be used in Ju

`Documentation on Read the Docs <https://nmrsim.readthedocs.io/>`_

nmrsim (version 0.4.0 beta)
nmrsim (version 0.5.0 beta)
============================

**nmrsim** is a Python library for the simulation of solution-state nuclear magnetic resonance (NMR) spectra.
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4 changes: 2 additions & 2 deletions docs/source/conf.py
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Expand Up @@ -25,9 +25,9 @@
author = 'Geoffrey M. Sametz'

# The short X.Y version
version = '0.4'
version = '0.5'
# The full version, including alpha/beta/rc tags
release = '0.4.0-beta'
release = '0.5.0-beta'


# -- General configuration ---------------------------------------------------
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15 changes: 10 additions & 5 deletions docs/source/introduction.rst
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@@ -1,4 +1,4 @@
Introduction to nmrsim v0.4.0 (beta)
Introduction to nmrsim v0.5.0 (beta)
=====================================

**nmrsim** is a library of tools for simulating NMR spectra, starting from
Expand All @@ -13,8 +13,13 @@ feature that you would like to see, or a barrier to you using this library,
feel free to open an issue on GitHub or to send the author email
(sametz at udel dot edu).

The project is inspired by the program `WINDNMR <https://www.chem.wisc.edu/areas/reich/plt/windnmr.htm>`_ by Hans
Reich. The goal for Version 1.0 of **nmrsim** is to provide Python tools for the same types of simulations that
WINDNMR did: first- and second-order simulation of spin-1/2 spin systems, plus simulation of some dynamic NMR (DNMR)
lineshapes. A longer-term goal is to expand the toolset (e.g. to allow higher-spin nuclei, or new DNMR models).
The project is inspired by the program
`WINDNMR <https://www.chem.wisc.edu/areas/reich/plt/windnmr.htm>`_
by Hans Reich.
The goal for Version 1.0 of **nmrsim** is to provide Python tools
for the same types of simulations that WINDNMR did:
first- and second-order simulation of spin-1/2 spin systems,
plus simulation of some dynamic NMR (DNMR) lineshapes.
A longer-term goal is to expand the toolset
(e.g. to allow higher-spin nuclei, or new DNMR models).

2 changes: 1 addition & 1 deletion nmrsim/__init__.py
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Expand Up @@ -62,4 +62,4 @@

from ._classes import Multiplet, SpinSystem, Spectrum # noqa: F401

__version__ = '0.4.0'
__version__ = '0.5.0'
2 changes: 1 addition & 1 deletion setup.py
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Expand Up @@ -5,7 +5,7 @@

setuptools.setup(
name="nmrsim",
version="0.4.0rc1",
version="0.5.0",
author="Geoffrey M. Sametz",
author_email="[email protected]",
description="A library for simulating nuclear magnetic resonance (NMR) spectra.",
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