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Releases: MDAnalysis/solvation-analysis

v0.4.2

26 Nov 21:37

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Release version 0.4.2

- Update Python requirements to >=3.11
- Update numpy to >=2.2
- Update pandas to >=2.2
- Update mdanalysis to >=2.8
- Update CI to test Python 3.11, 3.12, 3.13
- Fix NumPy 2.0 compatibility (np.NaN -> np.nan)
- Fix paper build (upgrade actions/upload-artifact)
- Fix ReadTheDocs configuration

v0.4.1

18 Jul 23:05
fd37875

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Unpin scipy to fix dependency resolution.

v0.4.0

09 May 23:33
c9957d6

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This includes improved plotting and visualization capabilities.

v0.3.5

01 Apr 18:37
8dca230

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Update dependencies to pandas 2.2 due to bug with 2.1

v0.3.4

14 Aug 16:56
055cbd9

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Small fix to allow arbitrary characters in solvent names

v0.3.3

22 Apr 01:13

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This release makes minor changes to the requirement handling to better synchronize with the conda release.

v0.3.2

06 Apr 16:17

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This adds plot_solvent_co_occurence, adds a coordination_vs_random property, and fixes authors in paper.md.

v0.3.1

02 Apr 16:22

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Very small READme change.

v0.3.0

02 Apr 16:06
de4afd4

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This release cleans up inconsistencies in the API, improves the documentation, and removes all hardlinks in the tutorials.

v0.2.0

14 Feb 19:05
d9ddba7

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This version finalizes improved documentation and adds a plotting module.