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Find atom patterns in molecular databases. Validate residues, ligands, and molecular fragments. PDB database validated using MotiveValidator. Compute, compare, and visualize atomic charges. Compute tunnels and their physico-chemical properties. Superimpose up to thousands of 3D structural fragments. Conformationally dependent atomic charges of quantum mechanics quality. Find atom patterns in molecules using the PatternQuery language.
Find atom patterns in molecular databases. Streaming of selected parts of 3D molecular data. Validate residues, ligands, and molecular fragments. PDB database validated using MotiveValidator. Compute, compare, and visualize atomic charges. A powerful 3D molecular viewer. Compute tunnels and their physico-chemical properties. Superimpose up to thousands of 3D structural fragments.
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