diff --git a/software/haddock2.4/changes.md b/software/haddock2.4/changes.md index 5c59f777..7be2dbfa 100644 --- a/software/haddock2.4/changes.md +++ b/software/haddock2.4/changes.md @@ -6,6 +6,21 @@ comments: false image: feature: pages/banner_software.jpg --- + +### Changes - version March 2026 (haddock2.5 only) +- Added missing improper parameters for NGA glycan +- Correct bug causing automatic reduction of the cluster size for reclustering to fail +- Added support for THR glycosylation + + +### Changes - version August 2025 (haddock2.5 only) +- Increased some array size parameters in the provided CNS code +- Added support for pyro-glutamic acid (PCA) +- Modified analysis to write stage-specific CNS average job files +- Simplified CNS execution scripts +- Added check of coordinates for consistency with the PDB format + + ### Changes - version December 2024 (haddock2.5 only) - Removed the minimisation of fully flexible regions during topology generation - Changed nucleic acid oxygen phosphage naming to OP1/OP2 (inline with PDB naming) @@ -76,7 +91,7 @@ image: - Added beta sialic acid (SIB), and additional linkages between glycans - Added modified DNA baseJ (DJ) - Corrected issue with automatic his protonation state -- Added automatic definition of restraints to maintain ions in their coordination sphere. +- Added automatic definition of restraints to maintain ions in their coordination sphere - Modified analysis scripts to work with a single ligand molecule diff --git a/software/haddock2.4/index.md b/software/haddock2.4/index.md index 597fc1b0..210db706 100644 --- a/software/haddock2.4/index.md +++ b/software/haddock2.4/index.md @@ -15,7 +15,7 @@ image: ![Structure + Binformatic/Biophysical Data => Complex](HADDOCK2.4.png) -_Version:_ 2.5 (December 2024) ([changes](/software/haddock2.4/changes)) +_Version:_ 2.5 (March 2026) ([changes](/software/haddock2.4/changes)) _Authors:_ Alexandre Bonvin and members of the computational structural biology group, Utrecht University