LABODOCK v2.0.0

🎉 LABODOCK v2.0.0 is here!

This update focuses on improving the code base, implementing informational molecular visualization, and fixing post-installation conda environment corruptions.

Most functions have been refactored and improved, and previous molecular visualization options have been reduced with new being added to provide informative visual inspection 👀. The conda environment is no longer corrupted by MGLTools package installation, and you can now install any other packages that require Python 3.10 or higher 🐍. The native ligand preparation step is now optional by default. Should you proceed without this phase, skip the 03 | Preparing the Native Ligand (optional) section ✨.

See full updates in CHANGELOG.md.

LABODOCK v1.2.2

Update CHANGELOG.md