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PreADMET | Prediction of ADME/ToxPreADMET | Prediction of ADME/Tox
PreADMET | Prediction of ADME/Tox
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Category Archives: 2D Topological Descriptors

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  4. Category "2D Topological Descriptors"
  5. (Page 67)

Chi_03_cluster

Kier & Hall molecular connectivity index order 3 (cluster)

January 9, 2015Leave a comment2D Descriptors, 2D Topological Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

Chi_04_path

Kier & Hall molecular connectivity index order 4 (path)

January 9, 2015Leave a comment2D Descriptors, 2D Topological Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

E_state_SHCsatu

Sum of hydrogen E-state for Csatu type

January 9, 2015Leave a comment2D Descriptors, 2D Topological Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

Chi_04_cluster

Kier & Hall molecular connectivity index order 4 (cluster)

January 9, 2015Leave a comment2D Descriptors, 2D Topological Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

E_state_SHAvin

Sum of hydrogen E-state for Avin type

January 9, 2015Leave a comment2D Descriptors, 2D Topological Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

Chi_04_path_cluster

Kier & Hall molecular connectivity index order 4 (path/cluster)

January 9, 2015Leave a comment2D Descriptors, 2D Topological Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

E_state_SHaaNH

Sum of hydrogen E-state for aaNH type

January 9, 2015Leave a comment2D Descriptors, 2D Topological Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

E_state_SHsNH3

Sum of hydrogen E-state for sNH3 type

January 9, 2015Leave a comment2D Descriptors, 2D Topological Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

E_state_SHssNH2

Sum of hydrogen E-state for ssNH2 type

January 9, 2015Leave a comment2D Descriptors, 2D Topological Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD

E_state_S_hbond_donor

Sum of E-state for Hbond donor

January 9, 2015Leave a comment2D Descriptors, 2D Topological Descriptors, Molecular DescriptorsBy Young-Mook Kang, PhD
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PreADMET | Prediction of ADME/Tox

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