Protein–RNA interactions, key in biological processes, remained refractory to prediction algorithms. RNA–protein complexes in the Protein Data Bank were decomposed…
NPDock is a novel web server developed for protein–nucleic acid docking that uses specific protein–nucleic acid statistical potentials for scoring…
The amount of structural information concerning protein–DNA complexes is increasing rapidly due to numerous efforts from the X-ray crystallography and…
Virtual screening (VS), often also referred to as in silico screening or protein based database screening, is a computational technique used in drug discovery to…
MD Simulation A molecular dynamics simulation is a potential function, or a description of the terms by which the particles in…
Protein-protein docking is the prediction of the structure of the complex, given the structures of the individual proteins. In the heart of…
Molecular docking is a widely used computer simulation procedure to predict the conformation of a receptor-ligand complex, where the receptor is usually…
Types of Docking Rigid (Lock and Key) Docking If the bond angles, bond lengths and torsion angles of the components…
Molecular docking is a key tool in structural molecular biology and computer-assisted drug design. The goal of ligand protein docking…
Receptors are proteins, usually cell surface receptors, which bind to ligands and cause responses in the immune system, including cytokine receptors, growth factor…