Tracking Molecular Movements Without the Guesswork

Visualizing atom motion is one of the most informative aspects of molecular modeling, but accurately keeping track of atomic positions across a custom animation or simulation can be tedious or error-prone. If you’ve ever tried to illustrate a docking process,…

Easily Create Vertical Flythroughs of Molecular Systems

Creating engaging molecular animations often means going beyond static visuals and tapping into smooth, precise camera movements. For molecular modelers preparing presentations, visualizations, or educational content, one constant challenge is showing structural complexity—such as layers of biomolecular assemblies or vertical…

Why Molecular Colors Matter More Than You Think

For molecular modelers, data visualization is not just aesthetic—it’s functional. The way atoms, residues, and molecules are colored can directly impact the clarity of your interpretations, the speed of your decision-making, and even the persuasiveness of your publications or presentations.…

Building Custom GROMACS Index Groups without the Guesswork

When working with large biomolecular systems using GROMACS, it’s often necessary to define custom index groups—for example, to specify pull groups for umbrella sampling, analyze specific subsets of atoms, or apply restraints. But creating these groups manually using gmx make_ndx…