Smoothly Animate Molecular Trajectories Between Keyframes in SAMSON

When working with molecular simulations, visualizing motion is essential to understand molecular mechanisms, reaction pathways, or conformational changes. Molecular modelers often run simulations that yield extensive trajectories—collections of molecular conformations over time. But how do you convert raw trajectory data…

Controlling Label Visibility in Molecular Models

Working with complex molecular systems in SAMSON can often lead to a visual overload: hundreds or even thousands of elements, each with its own properties, behavior, and labels. While labels are tremendously helpful for identification, analysis, or presentations, they can…

How to Precisely Control Fragment Orientation When Building Molecules

When modeling complex molecular structures, one of the most common — and frustrating — pain points for molecular modelers is achieving the precise spatial arrangement of molecular fragments. Whether you’re building ligands, assembling macromolecular complexes, or preparing simulation-ready systems, accurate…

Editing Molecules on the Fly: Dynamic Topology with IM-UFF

If you’ve ever tried to interactively modify molecular models during a simulation—adding atoms, breaking or forming bonds—you probably ran into the challenge of keeping energies consistent and topologies valid. For molecular modelers, working with fixed topologies can be limiting, especially…