= Phenix = === AlphaFold2 Barbed Wire === * Show [https://pubmed.ncbi.nlm.nih.gov/40937679/ Richardson lab categorization] of !AlphaFold structures * Based on feedback: - Color atoms as well as ribbons - Filter out structures with missing structure from command/tool - Simple results dialog - Tweaked "uncategorized" color * Elaine created help pages === Local EM Fitting === * Due to changes in Phenix's naming of default JSON output files, use explicit output file name Put bundle with all the above on Toolshed = ChimeraX completed = * Find Cavities/kvfinder improvements (Tristan suggestions) - Specify search box by using a set of atoms (and a pad value) instead of x/y/z/width/height/depth - Allow non-polymeric atoms to be treated as part of the receptor * Scene support - 2D label interpolation - Ribbon styles - Better interpolation of pseudobonds and coordinate sets * Made Gromacs reader use less peak memory * Made local Modeller execution not mistakenly require specifying a license key * Profile Grid - Show changes in prevalence based on chosen cells - Allow cells corresponding to a particular sequence to be chosen - Headers containing individual sequences - Turn off auto-association for very large alignments * Added 'is_reference' attribute to Sequence class - For sequences whose numbering should not be changed regardless of structure association (e.g. !UniProt) * OpenMM - Doesn't like non-unique names in a residue - Doesn't like missing backbone atoms * Now that Qt no longer remembers editor custom colors automatically, do it ourselves * Render By Attribute - Programmatically configurable - Show it in more cases: !Clashes/Contacts tools; defattr; measure mapvalues * Updated docs to use Sphinx [https://pydata-sphinx-theme.readthedocs.io/en/stable/index.html PyData] theme * !ViewDock shows count of compounds listed in table