MDAnalysis/GridDataFormats: 1.1.0

New minor release with enhancements and fixes.... and a new logo!

Supported environments

This is a pure Python package and should be available on all platforms.

• supports Python 3.11 - 3.14
• dropped support for Python 3.9 and 3.10 as per SPEC0

Notable Changes

• added MRC file writing support (#108)
• Grid now accepts binary operations with any operand that can be broadcasted to the grid's shape according to numpy broadcasting rules (PR #142)
• Grid now allows forcing MRC/CCP4 maps to be read as volumes even when the header indicates they are stacks of 2D images. (#150)
• tests and test datafiles are now included in the distribution; its size increased to ~5MB (#156)

Detailed changes by PR

• fix doc deployment by @orbeckst in https://github.com/MDAnalysis/GridDataFormats/pull/133
• use MDA docs in README.rst by @orbeckst in https://github.com/MDAnalysis/GridDataFormats/pull/135
• Update deploy for OIDC credentials by @IAlibay in https://github.com/MDAnalysis/GridDataFormats/pull/136
• fix syntax error in deployment by @orbeckst in https://github.com/MDAnalysis/GridDataFormats/pull/137
• Modernize packaging by @IAlibay in https://github.com/MDAnalysis/GridDataFormats/pull/138
• Bump to miniforge and py3.13 by @IAlibay in https://github.com/MDAnalysis/GridDataFormats/pull/139
• Bump to Py3.14 by @IAlibay in https://github.com/MDAnalysis/GridDataFormats/pull/140
• Fix compatibility for binary operations by @ollyfutur in https://github.com/MDAnalysis/GridDataFormats/pull/142
• updated logo by @orbeckst in https://github.com/MDAnalysis/GridDataFormats/pull/144
• updated links to discussion forum by @orbeckst in https://github.com/MDAnalysis/GridDataFormats/pull/146
• Better volumetric test by @PlethoraChutney in https://github.com/MDAnalysis/GridDataFormats/pull/149
• Add MRC file writing support by @Pradyumn-cloud in https://github.com/MDAnalysis/GridDataFormats/pull/147
• prepare for 1.1.0 release by @orbeckst in https://github.com/MDAnalysis/GridDataFormats/pull/152
• update deployment workflow by @orbeckst in https://github.com/MDAnalysis/GridDataFormats/pull/154

New Contributors

• @ollyfutur made their first contribution in https://github.com/MDAnalysis/GridDataFormats/pull/142
• @PlethoraChutney made their first contribution in https://github.com/MDAnalysis/GridDataFormats/pull/149
• @Pradyumn-cloud made their first contribution in https://github.com/MDAnalysis/GridDataFormats/pull/147

Full Changelog: https://github.com/MDAnalysis/GridDataFormats/compare/1.0.2...1.1.0