/* * $Id$ * * Copyright (c) 2010, Novartis Institutes for BioMedical Research Inc. * All rights reserved. * * Redistribution and use in source and binary forms, with or without * modification, are permitted provided that the following conditions are * met: * * * Redistributions of source code must retain the above copyright * notice, this list of conditions and the following disclaimer. * * Redistributions in binary form must reproduce the above * copyright notice, this list of conditions and the following * disclaimer in the documentation and/or other materials provided * with the distribution. * * Neither the name of Novartis Institutes for BioMedical Research Inc. * nor the names of its contributors may be used to endorse or promote * products derived from this software without specific prior written permission. * * THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS * "AS IS" AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT * LIMITED TO, THE IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR * A PARTICULAR PURPOSE ARE DISCLAIMED. IN NO EVENT SHALL THE COPYRIGHT * OWNER OR CONTRIBUTORS BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL, * SPECIAL, EXEMPLARY, OR CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT * LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES; LOSS OF USE, * DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY * THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT * (INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE * OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE. */ %typemap(javaimports) RDKit::Bond " /** class for representing a bond
@notes
This is an overloaded member function, provided for convenience. It differs from the above function only in what argument(s) it accepts. */ public"; %javamethodmodifiers RDKit::Bond::clearProp ( const char * key ) const " /**
clears the value of a property
@notes
@return a copy
@notes Reimplemented in RDKit::QueryBond. */ public"; %javamethodmodifiers RDKit::Bond::getBeginAtom ( ) const" /**
@return a pointer to our begin Atom
@notes
@return the index of our begin Atom
@notes
@return a pointer to our end Atom
@notes
@return the index of our end Atom
@notes
@return our index within the ROMol
@notes
@return a pointer to the other Atom
@notes
given the index of one Atom, returns the index of the other
@notes
This is an overloaded member function, provided for convenience. It differs from the above function only in what argument(s) it accepts.
template
allows retrieval of a particular property value
@param
key the name under which the property should be stored. If a property is already stored under this name, it will be replaced.
res a reference to the storage location for the value.
@notes
This is an overloaded member function, provided for convenience. It differs from the above function only in what argument(s) it accepts.
*/
public";
%javamethodmodifiers RDKit::Bond::getValenceContrib ( const Atom * at ) const"
/**
@return
our contribution to the explicit valence of an Atom
@notes
This is an overloaded member function, provided for convenience. It differs from the above function only in what argument(s) it accepts.
*/
public";
%javamethodmodifiers RDKit::Bond::Match ( const Bond::BOND_SPTR what ) const "
/**
This is an overloaded member function, provided for convenience. It differs from the above function only in what argument(s) it accepts.
Reimplemented in RDKit::QueryBond.
*/
public";
%javamethodmodifiers RDKit::Bond::Match ( Bond const * what ) const "
/**
@return
whether or not we match the argument
@notes
This is an overloaded member function, provided for convenience. It differs from the above function only in what argument(s) it accepts.
*/
public";
%javamethodmodifiers RDKit::Bond::setBeginAtom ( Atom * at ) "
/**
sets our begin Atom
@notes
sets the index of our begin Atom
@notes
This is an overloaded member function, provided for convenience. It differs from the above function only in what argument(s) it accepts.
*/
public";
%javamethodmodifiers RDKit::Bond::setEndAtom ( Atom * at ) "
/**
sets our end Atom
@notes
sets the index of our end Atom
@notes
sets our index within the ROMol
@notes
This is an overloaded member function, provided for convenience. It differs from the above function only in what argument(s) it accepts.
template
sets a property value
@param
key the name under which the property should be stored. If a property is already stored under this name, it will be replaced.
val the value to be stored
computed (optional) allows the property to be flagged computed.
*/
public";
%javamethodmodifiers RDKit::Bond::updatePropertyCache ( bool strict = true ) "
/**
calculates any of our lazy properties
@notes
calculates any of our lazy properties
@notes