<!DOCTYPE HTML PUBLIC "-//W3C//DTD HTML 4.0 Transitional//EN"> <html><head><meta name="robots" content="noindex"> <meta http-equiv="Content-Type" content="text/html;charset=iso-8859-1"> <title>Member List</title> <link href="doxygen.css" rel="stylesheet" type="text/css"> </head><body bgcolor="#ffffff"> <!-- Generated by Doxygen 1.2.5 on Mon Oct 14 14:17:58 2002 --> <center> <a class="qindex" href="index.html">Main Page</a> <a class="qindex" href="hierarchy.html">Class Hierarchy</a> <a class="qindex" href="annotated.html">Compound List</a> <a class="qindex" href="files.html">File List</a> <a class="qindex" href="functions.html">Compound Members</a> <a class="qindex" href="pages.html">Related Pages</a> </center> <hr><h1>sc::SymmMolecularCoor Member List</h1>This is the complete list of members for <a class="el" href="class_sc__SymmMolecularCoor.html">sc::SymmMolecularCoor</a>, including all inherited members.<ul> <li><b>all_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__IntMolecularCoor.html#a6">all_to_cartesian</a>(const Ref< Molecule > &,RefSCVector &internal) <code> [virtual]</code><li><a class="el" href="class_sc__IntMolecularCoor.html#a7">all_to_internal</a>(const Ref< Molecule > &,RefSCVector &internal) <code> [virtual]</code><li><b>bends_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>bonds_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>cartesian_tolerance_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__SymmMolecularCoor.html#a8">change_coordinates</a>() <code> [virtual]</code><li><b>change_coordinates_</b> (defined in <a class="el" href="class_sc__SymmMolecularCoor.html">sc::SymmMolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__DescribedClass.html#a4">class_desc</a>() const <li><a class="el" href="class_sc__DescribedClass.html#a5">class_name</a>() const <li><a class="el" href="class_sc__DescribedClass.html#a6">class_version</a>() const <li><b>constant_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>coordinate_tolerance_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>debug_</b> (defined in <a class="el" href="class_sc__MolecularCoor.html">sc::MolecularCoor</a>)<code> [protected]</code><li><b>decouple_bends_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>decouple_bonds_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__RefCount.html#a6">dereference</a>() <code> [inline]</code><li><b>DescribedClass</b>() (defined in <a class="el" href="class_sc__DescribedClass.html">sc::DescribedClass</a>)<li><b>DescribedClass</b>(const DescribedClass &) (defined in <a class="el" href="class_sc__DescribedClass.html">sc::DescribedClass</a>)<li><a class="el" href="class_sc__IntMolecularCoor.html#a8">dim</a>() <code> [virtual]</code><li><b>dim_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__MolecularCoor.html#a5">dim_natom3</a>() <code> [inline]</code><li><b>dir_restore_state</b>(StateIn &si, const char *objectname, const char *keyword=0) (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<code> [static]</code><li><b>dnatom3_</b> (defined in <a class="el" href="class_sc__MolecularCoor.html">sc::MolecularCoor</a>)<code> [protected]</code><li><b>dvc_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>extra_bonds_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>extras_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>fixed_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>followed_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__SymmMolecularCoor.html#a5">form_coordinates</a>(int keep_variable=0) <code> [virtual]</code><li><b>form_K_matrix</b>(RefSCDimension &dredundant, RefSCDimension &dfixed, RefSCMatrix &K, int *&is_totally_symmetric) (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>form_print_constant_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>form_print_molecule_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>form_print_simples_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>form_print_variable_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>generator_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>given_fixed_values_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__SymmMolecularCoor.html#a6">guess_hessian</a>(RefSymmSCMatrix &hessian) <code> [virtual]</code><li><a class="el" href="class_sc__Identity.html#a1">identifier</a>() <code> [inline]</code><li><a class="el" href="class_sc__SymmMolecularCoor.html#b0">init</a>() <code> [protected, virtual]</code><li><b>IntMolecularCoor</b>(StateIn &) (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<li><b>IntMolecularCoor</b>(Ref< Molecule > &mol) (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<li><a class="el" href="class_sc__IntMolecularCoor.html#a2">IntMolecularCoor</a>(const Ref< KeyVal > &) <li><a class="el" href="class_sc__SymmMolecularCoor.html#a7">inverse_hessian</a>(RefSymmSCMatrix &) <code> [virtual]</code><li><a class="el" href="class_sc__SavableState.html#d2">key_restore_state</a>(StateIn &si, const char *keyword) <code> [static]</code><li><a class="el" href="class_sc__RefCount.html#a1">lock_ptr</a>() const <li><a class="el" href="class_sc__RefCount.html#a7">managed</a>() const <code> [inline]</code><li><a class="el" href="class_sc__RefCount.html#a9">managed</a>() const <code> [inline]</code><li><b>matrixkit</b>() const (defined in <a class="el" href="class_sc__MolecularCoor.html">sc::MolecularCoor</a>)<code> [inline]</code><li><b>matrixkit_</b> (defined in <a class="el" href="class_sc__MolecularCoor.html">sc::MolecularCoor</a>)<code> [protected]</code><li><b>max_kappa2_</b> (defined in <a class="el" href="class_sc__SymmMolecularCoor.html">sc::SymmMolecularCoor</a>)<code> [protected]</code><li><b>max_update_disp_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>max_update_steps_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>MolecularCoor</b>(Ref< Molecule > &) (defined in <a class="el" href="class_sc__MolecularCoor.html">sc::MolecularCoor</a>)<li><b>MolecularCoor</b>(StateIn &) (defined in <a class="el" href="class_sc__MolecularCoor.html">sc::MolecularCoor</a>)<li><a class="el" href="class_sc__MolecularCoor.html#a2">MolecularCoor</a>(const Ref< KeyVal > &) <li><a class="el" href="class_sc__MolecularCoor.html#a6">molecule</a>() const <code> [inline]</code><li><b>molecule_</b> (defined in <a class="el" href="class_sc__MolecularCoor.html">sc::MolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__IntMolecularCoor.html#a19">nconstrained</a>() <code> [virtual]</code><li><a class="el" href="class_sc__IntMolecularCoor.html#b2">new_coords</a>() <code> [protected, virtual]</code><li><b>nextra_bonds_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__RefCount.html#a4">nreference</a>() const <code> [inline]</code><li><b>only_totally_symmetric_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>operator=</b>(const SavableState &) (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<li><b>operator=</b>(const DescribedClass &) (defined in <a class="el" href="class_sc__DescribedClass.html">sc::DescribedClass</a>)<li><b>operator=</b>(const RefCount &) (defined in <a class="el" href="class_sc__RefCount.html">sc::RefCount</a>)<code> [inline, protected]</code><li><b>outs_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__SymmMolecularCoor.html#a9">print</a>(std::ostream &=ExEnv::out0()) const <code> [virtual]</code><li><b>print_constant</b>(std::ostream &=ExEnv::out0()) const (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [virtual]</code><li><b>print_simples</b>(std::ostream &=ExEnv::out0()) const (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [virtual]</code><li><b>print_variable</b>(std::ostream &=ExEnv::out0()) const (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [virtual]</code><li><a class="el" href="class_sc__IntMolecularCoor.html#b3">read_keyval</a>(const Ref< KeyVal > &) <code> [protected, virtual]</code><li><b>RefCount</b>() (defined in <a class="el" href="class_sc__RefCount.html">sc::RefCount</a>)<code> [inline, protected]</code><li><b>RefCount</b>(const RefCount &) (defined in <a class="el" href="class_sc__RefCount.html">sc::RefCount</a>)<code> [inline, protected]</code><li><a class="el" href="class_sc__RefCount.html#a5">reference</a>() <code> [inline]</code><li><a class="el" href="class_sc__SavableState.html#d1">restore_state</a>(StateIn &si) <code> [static]</code><li><b>SavableState</b>() (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<code> [protected]</code><li><b>SavableState</b>(const SavableState &) (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<code> [protected]</code><li><a class="el" href="class_sc__SavableState.html#b2">SavableState</a>(StateIn &) <code> [protected]</code><li><a class="el" href="class_sc__SymmMolecularCoor.html#a4">save_data_state</a>(StateOut &) <code> [virtual]</code><li><a class="el" href="class_sc__SavableState.html#a3">save_object_state</a>(StateOut &) <li><a class="el" href="class_sc__SavableState.html#a2">save_state</a>(StateOut &) <li><b>save_state</b>(SavableState *s, StateOut &) (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<code> [static]</code><li><a class="el" href="class_sc__SavableState.html#a4">save_vbase_state</a>(StateOut &) <code> [virtual]</code><li><b>scale_bends_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>scale_bonds_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>scale_outs_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>scale_tors_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>simple_tolerance_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>symmetry_tolerance_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>SymmMolecularCoor</b>(Ref< Molecule > &mol) (defined in <a class="el" href="class_sc__SymmMolecularCoor.html">sc::SymmMolecularCoor</a>)<li><b>SymmMolecularCoor</b>(StateIn &) (defined in <a class="el" href="class_sc__SymmMolecularCoor.html">sc::SymmMolecularCoor</a>)<li><a class="el" href="class_sc__SymmMolecularCoor.html#a2">SymmMolecularCoor</a>(const Ref< KeyVal > &) <li><b>to_cartesian</b>(const Ref< Molecule > &,const RefSCVector &internal) (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [virtual]</code><li><a class="el" href="class_sc__IntMolecularCoor.html#a11">to_cartesian</a>(RefSCVector &cartesian, RefSCVector &internal) <code> [virtual]</code><li><a class="el" href="class_sc__IntMolecularCoor.html#a13">to_cartesian</a>(RefSymmSCMatrix &cart, RefSymmSCMatrix &internal) <code> [virtual]</code><li><a class="el" href="class_sc__MolecularCoor.html#a10">sc::MolecularCoor::to_cartesian</a>(const RefSCVector &internal) <li><a class="el" href="class_sc__IntMolecularCoor.html#a10">to_internal</a>(RefSCVector &internal) <code> [virtual]</code><li><a class="el" href="class_sc__IntMolecularCoor.html#a12">to_internal</a>(RefSCVector &internal, RefSCVector &cartesian) <code> [virtual]</code><li><a class="el" href="class_sc__IntMolecularCoor.html#a14">to_internal</a>(RefSymmSCMatrix &internal, RefSymmSCMatrix &cart) <code> [virtual]</code><li><b>tors_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>transform_hessian_</b> (defined in <a class="el" href="class_sc__SymmMolecularCoor.html">sc::SymmMolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__RefCount.html#a2">unlock_ptr</a>() const <li><a class="el" href="class_sc__RefCount.html#a8">unmanage</a>() <code> [inline]</code><li><b>update_bmat_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><a class="el" href="class_sc__RefCount.html#a3">use_locks</a>(bool inVal) <li><b>variable_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>watched_</b> (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [protected]</code><li><b>~DescribedClass</b>() (defined in <a class="el" href="class_sc__DescribedClass.html">sc::DescribedClass</a>)<code> [virtual]</code><li><b>~Identity</b>() (defined in <a class="el" href="class_sc__Identity.html">sc::Identity</a>)<code> [virtual]</code><li><b>~IntMolecularCoor</b>() (defined in <a class="el" href="class_sc__IntMolecularCoor.html">sc::IntMolecularCoor</a>)<code> [virtual]</code><li><b>~MolecularCoor</b>() (defined in <a class="el" href="class_sc__MolecularCoor.html">sc::MolecularCoor</a>)<code> [virtual]</code><li><b>~RefCount</b>() (defined in <a class="el" href="class_sc__RefCount.html">sc::RefCount</a>)<code> [virtual]</code><li><b>~SavableState</b>() (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<code> [virtual]</code><li><b>~SymmMolecularCoor</b>() (defined in <a class="el" href="class_sc__SymmMolecularCoor.html">sc::SymmMolecularCoor</a>)<code> [virtual]</code></ul> <hr> <address> <small> Generated at Mon Oct 14 14:17:58 2002 for <a href="http://aros.ca.sandia.gov/~cljanss/mpqc">MPQC</a> 2.1.2 using the documentation package <a href="http://www.stack.nl/~dimitri/doxygen/index.html">Doxygen</a> 1.2.5. </small> </address> </body> </html>