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None | __init__ () |
| | Creates an empty list.
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| None | __init__ (ORAtomMatchExpressionList expr) |
| | Contructs a copy of the ORAtomMatchExpressionList instance expr. More...
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| ORAtomMatchExpressionList | assign (ORAtomMatchExpressionList expr) |
| | Replaces the current state with a copy of the state of the ORAtomMatchExpressionList instance expr. More...
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| None | __init__ (AtomMatchExpressionList expr) |
| | Contructs a copy of the AtomMatchExpressionList instance expr. More...
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| int | getObjectID () |
| | Returns the numeric identifier (ID) of the wrapped C++ class instance. More...
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| int | getSize () |
| | Returns the number of elements stored in the list. More...
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| bool | isEmpty () |
| | Tells whether the list is empty (getSize() == 0). More...
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| None | resize (int num_elem, AtomMatchExpression value) |
| | Inserts or erases elements at the end so that the size becomes num_elem. More...
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| None | reserve (int num_elem) |
| | Preallocates memory for (at least) num_elem elements. More...
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| int | getCapacity () |
| | Returns the number of elements for which memory has been allocated. More...
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None | clear () |
| | Erases all elements.
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| AtomMatchExpressionList | assign (AtomMatchExpressionList list) |
| | Replaces the current state with a copy of the state of the AtomMatchExpressionList instance list. More...
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| None | assign (int num_elem, AtomMatchExpression value) |
| | This function fills the array with num_elem copies of the given value. More...
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| None | addElement (AtomMatchExpression value) |
| | Adds a new element at the end of the list. More...
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| None | addElements (AtomMatchExpressionList values) |
| | Adds the elements of values to the end of the list. More...
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| None | insertElement (int idx, AtomMatchExpression value) |
| | Inserts a new element before the location specified by the index idx. More...
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| None | insertElements (int idx, int num_elem, AtomMatchExpression value) |
| | Inserts num_elem copies of value before the location specified by the index idx. More...
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| None | insertElements (int idx, AtomMatchExpressionList values) |
| | Insert the elements of values before the location specified by the index idx. More...
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| None | popLastElement () |
| | Removes the last element of the list. More...
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| None | removeElement (int idx) |
| | Removes the element at index idx. More...
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| None | removeElements (int begin_idx, int end_idx) |
| | Removes the elements at indices in the range [begin_idx, end_idx). More...
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| AtomMatchExpression | getFirstElement () |
| | Returns the first element of the list. More...
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| AtomMatchExpression | getLastElement () |
| | Returns the last element of the list. More...
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| AtomMatchExpression | getElement (int idx) |
| | Returns the element at index idx. More...
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| None | setElement (int idx, AtomMatchExpression value) |
| | Assigns a new value to the element at index idx. More...
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| bool | requiresAtomBondMapping () |
| | Tells whether the expression list requires a reevaluation after a query to target atom mapping candidate has been found. More...
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| None | __delitem__ (int idx) |
| | Removes the element at index idx. More...
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| AtomMatchExpression | __getitem__ (int idx) |
| | Returns the element at index idx. More...
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| int | __len__ () |
| | Returns the number of elements stored in the list. More...
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| None | __setitem__ (int idx, AtomMatchExpression value) |
| | Assigns a new value to the element at index idx. More...
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| bool | __eq__ (object expr) |
| | Returns the result of the comparison operation self == expr. More...
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| bool | __ne__ (object expr) |
| | Returns the result of the comparison operation self != expr. More...
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| bool | __call__ (Atom query_atom, MolecularGraph query_molgraph, Atom target_atom, MolecularGraph target_molgraph, Base.Any aux_data) |
| | Performs an evaluation of the expression for the given query and target objects. More...
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| bool | __call__ (Atom query_atom, MolecularGraph query_molgraph, Atom target_atom, MolecularGraph target_molgraph, AtomBondMapping mapping, Base.Any aux_data) |
| | Performs an evaluation of the expression for the given query and target objects under consideration of the provided candidate atom/bond mapping. More...
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Chem.AtomMatchExpressionList implementation that evaluates the stored expressions as a logical disjunction (OR).
The list evaluates to True as soon as one contained Chem.AtomMatchExpression instance evaluates to True for the given query/target atom pairs (short-circuit evaluation). An empty list evaluates to False.
Inheritance diagram for CDPL.Chem.ORAtomMatchExpressionList:
1.9.1