Visualize and edit structures
Interactive 3D visualization and editing of molecular and crystal structures, plus a 2D molecule sketcher with SMILES import and export.
SilicoLab
Computational environment for chemistry, biology & materials research.
Run real calculations
Force-field geometry optimization, quantum chemistry, and guided molecular dynamics powered by GROMACS.
Build reticular materials
Assemble COFs and MOFs from building blocks with the reticular structure builder.
Automate everything
One scripting language for the GUI console and the headless CLI — the same script runs in both.