Author: OneAngstrom
A Cleaner Exit: How to Make Atoms Disappear in Molecular Animations Without Transparency
Keeping Your Focus: How to Keep a Molecular Region in View as It Moves
Quickly Generate Molecular Analogues with SMILES Manager’s Pattern Scanner
Designing molecular analogues is a common approach in medicinal chemistry to explore structure-activity relationships and optimize compounds. However, scanning and editing molecular substructures manually can be both slow and error-prone. If you’re looking for a way to streamline analogue generation…
Replacing Guesswork with Data: Refining Ligand Unbinding Using P-NEB in SAMSON
Easier Trajectory Playback in SAMSON: Using the Play Path Animation
A Precise Way to Select Atoms with Mathematical Expressions in SAMSON
When modeling complex molecular systems, selecting specific atoms—even in large structures—can become a repetitive and error-prone task. Whether you’re visualizing a nano-structure or preparing data for simulation, quickly defining regions of interest is often critical. Yet doing this manually using…







