OEChem - Python Theory Manual
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8.1 Stored Properties of
8. Properties of Atoms
Subsections
8.1 Stored Properties of Atoms
8.1.1 AtomicNum
8.1.2 FormalCharge
8.1.3 ImplicitHCount
8.1.4 Isotope
8.1.5 PartialCharge
8.1.6 Hyb
8.1.7 IntType
8.1.8 Name
8.1.9 Type
8.1.10 Radius
8.1.11 RxnRole
8.1.12 MapIdx
8.1.13 InRing
8.1.14 SymmetryClass
8.1.15 Aromatic
8.2 Derived Properties of Atoms
8.2.1 GetDegree
8.2.2 GetExplicitDegree
8.2.3 GetExplicitHCount
8.2.4 GetExplicitValence
8.2.5 GetHvyDegree
8.2.6 GetHvyValence
8.2.7 GetParent
8.2.8 GetTotalHCount
8.2.9 GetValence
8.2.10 GetIdx
8.2.11 IsCarbon
8.2.12 IsConnected
8.2.13 IsHalogen
8.2.14 IsHydrogen
8.2.15 IsMetal
8.2.16 IsNitrogen
8.2.17 IsOxygen
8.2.18 IsPhosphorus
8.2.19 IsPolarHydrogen
8.2.20 IsSulfur
OEChem - Python Theory Manual
Previous:
7.5 Using OEChem C++
Up:
OEChem - Python Theory
Next:
8.1 Stored Properties of
Documentation released on June 4, 2008.
