Convert XYZ data to bond lengths & angles, calculate contacts, planes and dihedral angles and print tables
visualization
viewer
table
angle
bond
orca
coordinates
xyz
tables
dihedral-angles
xyz-reader
length
xyz-files
orca-quantum-chemistry
torsion-angles
molecule-visualization
dft-calculations
xmol
xyz-viewer
best-fit-plane
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Updated
Feb 22, 2024 - Python