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radi0sus / advanced_xyz2tab

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Convert XYZ data to bond lengths & angles, calculate contacts, planes, dihedral angles, ring parameters, CShM, VdW-Volume and area, several molecular radii & diffusion coefficients, and print tables

visualization angle nmr bond sdf xyz rings dihedral-angles cremer-pople diffusion-coefficient planes torsion-angles molecule-visualization dosy molecular-volume tau4 tau5 best-fit-plane plane-angle continuous-shape-measures
  • Updated Aug 10, 2026
  • JavaScript

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