v1.1.0

Virtual machine with all software and sample data to run 3D-e-Chem Knime workflows.

Vagrant box at https://atlas.hashicorp.com/nlesc/boxes/3d-e-chem/versions/1.1.0

Changed

• Based on Chemical Analytics Platform 0.8.0
• Upgraded RDKit to 2016.03.1
• Upgraded Ubuntu to 16.04
• Upgraded Knime to v3.1.2
• Upgraded Virtualbox Guest Additions to v5.0.20

Added

• ss-TEA Knime node