Category Archives: 3D Descriptors

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Molecular Descriptors
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Inertial shape factor

January 28, 20153D Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

Topological electronic descriptors of all pairs

January 28, 20153D Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

3D asphericity

January 28, 20153D Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

Topological electronic descriptors of all bonds

January 28, 20153D Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

molecular eccentricity

January 28, 20153D Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

Radius of the smallest sphere, on the center of mass enclosing all atoms

January 28, 20153D Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD