MDAnalysis/mdanalysis package-2.6.1 on GitHub

Release 2.6.1 of MDAnalysis

This is a bugfix release of the 2.6.x version branch of MDAnalysis, it serves as an amendment to the earlier released version 2.6.0.

See the CHANGELOG for more details.

Reverting the v2.6.0 behaviour, builds are now again made using the oldest supported NumPy version (NumPy 1.22.3 for Python 3.9-3.10, and 1.22.3 for Python 3.11) [PR #4261]
Uses of numpy in1d have been replaced with isin in prepartion for NumPy 2.0 [PR #4255]
Cython DEF statements have been replaced with compile time integer constants as DEF statements are now deprecated in Cython 3.0 [Issue #4237, PR #4246]
Fix to element guessing code to more accurately interpret atom names split by numbers (i.e. N0A is now recognised as N rather than NA) [Issue #4167, PR #4168]
Clarification of SurvivalProbability function documentation [Issue #4247, PR #4248]1