This PyMOL plugin is designed to process, filter, and analyze SwissDock docking results. It automates the extraction of ligand binding poses, filters them based on their distance to specific binding ...

1. Autodetect box: Fetch the box with one click of mouse or use the code autobox 5.0 2. Get box from selection (sele) Select ligands or residues, then click the menu or use the code getbox (sele), 5.0 ...

Optibrium, a leading developer of software and AI solutions for molecular design today announced the introduction of a new PyMOL Graphical User Interface (GUI) for Surflex-Dock, its industry-leading ...

ABSTRACT: Activation and expansion of drug reactive T cells are key features in drug hypersensitivity reactions. Drugs may interact directly with immune receptors such as the human leukocyte antigens ...

Introduction: Computational Molecular Docking is a resource that has emerged from the advent of bioinformatics, enabling analysis of binding affinities through 3D protein structure modeling.