A Precise Way to Select Atoms in Complex Structures

When working with molecular structures, modelers frequently face a common challenge: selecting specific groups of atoms based on complex spatial or chemical criteria. Scrolling through long atomic lists, manual picking, or relying on external scripts can be tedious and error-prone,…

How Bond Order Filters Could Save You Hours in Molecular Editing

For molecular modelers and computational chemists, identifying specific types of bonds—like those with fractional bond orders in conjugated systems—can often involve a mix of guesswork and manual inspection. Whether you’re refining a force field, preparing a simulation, or analyzing resonance…