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// -*- Mode: C++; tab-width: 2; -*-
// vi: set ts=2:
//
#include <BALL/KERNEL/expression.h>
#include <BALL/KERNEL/standardPredicates.h>
#include <BALL/CONCEPT/factory.h>
using namespace::std;
namespace BALL
{
// Expression class, frontend to ExpressionTree
Expression::Expression()
: create_methods_(),
expression_tree_(0),
expression_string_("<not initialized>")
{
registerStandardPredicates_();
}
Expression::Expression(const Expression& expression)
: create_methods_(expression.create_methods_),
expression_tree_(new ExpressionTree(*expression.expression_tree_)),
expression_string_(expression.expression_string_)
{
}
Expression::Expression(const String& expression_string)
: create_methods_(),
expression_tree_(0),
expression_string_("")
{
registerStandardPredicates_();
// Use this method instead of ctor initialization because it builds a
// whole expression tree.
setExpression(expression_string);
}
Expression::~Expression()
{
clear();
}
void Expression::clear()
{
delete expression_tree_;
expression_tree_ = 0;
expression_string_ = "<not initialized>";
}
Expression& Expression::operator = (const Expression& expression)
{
// don't use clear() here (for performance reasons, create_methods_ is
// rebuilt by clear() and we had to clear() it again.
create_methods_.clear();
delete expression_tree_;
expression_string_.clear();
create_methods_ = expression.create_methods_;
expression_tree_ = new ExpressionTree(*expression.expression_tree_);
expression_string_ = expression.expression_string_;
return *this;
}
bool Expression::operator == (const Expression& expression) const
{
if ((expression_tree_ == 0) && (expression.expression_tree_ == 0))
{
// both pointers are null pointers. Expressions should have null
// pointers only if they are default constructed, so a consistency
// check might be useful (the string should be empty; maybe later)
return (expression_string_ == expression.expression_string_);
}
else
{
if ((expression_tree_ == 0) || (expression.expression_tree_ == 0))
{
// one of the pointers is NULL. The instances cannot be equal.
return false;
}
else
{
return ((*expression_tree_ == *expression.expression_tree_)
&& (expression_string_ == expression.expression_string_));
}
}
}
bool Expression::hasPredicate(const String& name) const
{
return create_methods_.has(name);
}
bool Expression::operator () (const Atom& atom) const
{
if (expression_tree_ != 0)
{
return expression_tree_->operator () (atom);
}
else
{
Log.error() << "Expression::operator (): no expression set" << endl;
return false;
}
}
ExpressionPredicate* Expression::getPredicate (const String& name, const String& args) const
{
CreationMethod create_method = create_methods_[name];
ExpressionPredicate* predicate = (ExpressionPredicate*)(create_method)();
predicate->setArgument(args);
return predicate;
}
void Expression::registerPredicate(const String& name, CreationMethod creation_method)
{
create_methods_.insert(name, creation_method);
}
void Expression::setExpression(const String& expression_string)
{
// don't use clear() here, because it also would delete create_methods_
if (expression_tree_ != 0)
{
delete expression_tree_;
expression_tree_ = 0;
}
// remember the expression
expression_string_ = expression_string;
// create a temporary tree from which the expression_tree_ can be built
ExpressionParser parser;
parser.parse(expression_string);
// construct the tree
expression_tree_ = constructExpressionTree_(parser.getSyntaxTree());
}
const String& Expression::getExpressionString() const
{
return expression_string_;
}
const ExpressionTree* Expression::getExpressionTree() const
{
return expression_tree_;
}
const StringHashMap<Expression::CreationMethod>& Expression::getCreationMethods() const
{
return create_methods_;
}
ExpressionTree* Expression::constructExpressionTree_(const ExpressionParser::SyntaxTree& t)
{
ExpressionTree* root = new ExpressionTree;
root->setType(t.type);
root->setNegate(t.negate);
if (t.type == ExpressionTree::LEAF)
{
if (hasPredicate(t.predicate))
{
root->setPredicate(getPredicate(t.predicate, t.argument));
}
else
{
delete root;
throw Exception::ParseError(__FILE__, 0,
String(t.predicate + "(" + t.argument + ")"),
"Predicate could not be found");
}
}
else
{
for (ExpressionParser::SyntaxTree::ConstIterator it = t.begin(); it != t.end(); ++it)
{
root->appendChild(constructExpressionTree_(**it));
}
}
return root;
}
void Expression::registerStandardPredicates_()
{
create_methods_.insert("true", (PersistenceManager::CreateMethod)Factory<TruePredicate>::createVoid);
create_methods_.insert("false", (PersistenceManager::CreateMethod)Factory<FalsePredicate>::createVoid);
create_methods_.insert("selected", (PersistenceManager::CreateMethod)Factory<SelectedPredicate>::createVoid);
create_methods_.insert("name", (PersistenceManager::CreateMethod)Factory<AtomNamePredicate>::createVoid);
create_methods_.insert("type", (PersistenceManager::CreateMethod)Factory<AtomTypePredicate>::createVoid);
create_methods_.insert("element", (PersistenceManager::CreateMethod)Factory<ElementPredicate>::createVoid);
create_methods_.insert("residue", (PersistenceManager::CreateMethod)Factory<ResiduePredicate>::createVoid);
create_methods_.insert("residueID", (PersistenceManager::CreateMethod)Factory<ResidueIDPredicate>::createVoid);
create_methods_.insert("protein", (PersistenceManager::CreateMethod)Factory<ProteinPredicate>::createVoid);
create_methods_.insert("secondaryStruct", (PersistenceManager::CreateMethod)Factory<SecondaryStructurePredicate>::createVoid);
create_methods_.insert("solvent", (PersistenceManager::CreateMethod)Factory<SolventPredicate>::createVoid);
create_methods_.insert("backbone", (PersistenceManager::CreateMethod)Factory<BackBonePredicate>::createVoid);
create_methods_.insert("chain", (PersistenceManager::CreateMethod)Factory<ChainPredicate>::createVoid);
create_methods_.insert("nucleotide", (PersistenceManager::CreateMethod)Factory<NucleotidePredicate>::createVoid);
create_methods_.insert("inRing", (PersistenceManager::CreateMethod)Factory<InRingPredicate>::createVoid);
create_methods_.insert("doubleBonds", (PersistenceManager::CreateMethod)Factory<DoubleBondsPredicate>::createVoid);
create_methods_.insert("tripleBonds", (PersistenceManager::CreateMethod)Factory<TripleBondsPredicate>::createVoid);
create_methods_.insert("aromaticBonds", (PersistenceManager::CreateMethod)Factory<AromaticBondsPredicate>::createVoid);
create_methods_.insert("numberOfBonds", (PersistenceManager::CreateMethod)Factory<NumberOfBondsPredicate>::createVoid);
create_methods_.insert("connectedTo", (PersistenceManager::CreateMethod)Factory<ConnectedToPredicate>::createVoid);
create_methods_.insert("sp3Hybridized", (PersistenceManager::CreateMethod)Factory<Sp3HybridizedPredicate>::createVoid);
create_methods_.insert("sp2Hybridized", (PersistenceManager::CreateMethod)Factory<Sp2HybridizedPredicate>::createVoid);
create_methods_.insert("spHybridized", (PersistenceManager::CreateMethod)Factory<SpHybridizedPredicate>::createVoid);
create_methods_.insert("charge", (PersistenceManager::CreateMethod)Factory<ChargePredicate>::createVoid);
create_methods_.insert("isAxial", (PersistenceManager::CreateMethod)Factory<AxialPredicate>::createVoid);
create_methods_.insert("is4C1", (PersistenceManager::CreateMethod)Factory<Conformation4C1Predicate>::createVoid);
create_methods_.insert("SMARTS", (PersistenceManager::CreateMethod)Factory<SMARTSPredicate>::createVoid);
}
}
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