From 2cf850788a530fd3a3f02ae21be943658e8e6faf Mon Sep 17 00:00:00 2001 From: Gabriel Studer <gabriel.studer@unibas.ch> Date: Sun, 25 Nov 2018 14:13:52 +0100 Subject: [PATCH] uppdate CHANGELOG --- CHANGELOG | 7 ++++++- 1 file changed, 6 insertions(+), 1 deletion(-) diff --git a/CHANGELOG b/CHANGELOG index 7fe8a482..d3c472d6 100644 --- a/CHANGELOG +++ b/CHANGELOG @@ -15,7 +15,12 @@ Release 1.3.0 rotamer library. All scripts required to reproduce the data are in extras/data_generation/rotamer_library * SampleMonteCarlo function moved to Python. This makes it possible to provide - sampler/closer/scorer/cooler objects implemented in both, Python and C++ + sampler/closer/scorer/cooler objects implemented in both, Python and C++ +* Action script for sidechain modelling +* Allow sequence profiles as input for build-model action script. +* Recipe for Docker / Singularity container +* Check peptide bonds when building a RawModel. Treat as gap if bond is + stereochemically problematic despite being in sequence. * Several minor bug fixes, improvements, and speed-ups -- GitLab