![]() |
Rosetta
2016.11
|
#include <core/chemical/sdf/mol_writer.hh>
#include <core/chemical/sdf/mol_util.hh>
#include <core/conformation/Residue.hh>
#include <core/chemical/AtomType.hh>
#include <core/chemical/ResidueType.hh>
#include <core/chemical/ResidueProperties.hh>
#include <utility/string_util.hh>
#include <utility/excn/Exceptions.hh>
#include <iomanip>
#include <iostream>
#include <algorithm>
#include <boost/foreach.hpp>
#include <boost/format.hpp>
#include <utility/vector1.hh>
#include <utility/io/ozstream.hh>
#include <basic/options/keys/out.OptionKeys.gen.hh>
#include <basic/options/option.hh>
#include <basic/Tracer.hh>
Namespaces | |
core | |
A class for reading in the atom type properties. | |
core::chemical | |
core::chemical::sdf | |
Functions | |
static THREAD_LOCAL basic::Tracer | core::chemical::sdf::tr ("core.chemical.sdf.mol_writer") |
this class outputs a residue in the form of a V3000 molfile, for details of the spec, see http://www.symyx.com/downloads/public/ctfile/ctfile.pdf