HOSECodeAnalyser (cdk 2.9 API)

java.lang.Object
- org.openscience.cdk.tools.HOSECodeAnalyser

```
public class HOSECodeAnalyser
extends Object
```
Analyses a molecular formula given in String format and builds an AtomContainer with the Atoms in the molecular formula. About implicit H handling: By default the methods to calculate formula, natural and canonical mass use the explicit Hs and only the explicit Hs if there is at least one in the molecule, implicit Hs are ignored. If there is no explicit H and only then the implicit Hs are used. If you use the constructor MFAnalyser(IAtomContainer ac, boolean useboth) and set useboth to true, all explicit Hs and all implicit Hs are used, the implicit ones also on atoms with explicit Hs.

Author:

egonw

Source code:
main

Belongs to CDK module:
extra

Created on:

2007-03-08

- Constructor Summary
  
  Constructors
  Constructor Description
  
  HOSECodeAnalyser()
- Method Summary
  
  All Methods Static Methods Concrete Methods
  Modifier and Type Method Description
  
  static List<String> getElements(String code)
  - Methods inherited from class java.lang.Object
    clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Constructor Detail
- HOSECodeAnalyser
```
public HOSECodeAnalyser()
```

Method Detail

getElements

public static List<String> getElements(String code)