__init__() | CDPL.ConfGen.TorsionLibrary | |
__init__(TorsionLibrary lib) | CDPL.ConfGen.TorsionLibrary | |
CDPL::ConfGen::TorsionCategory.__init__(TorsionCategory cat) | CDPL.ConfGen.TorsionCategory | |
addCategory(TorsionCategory cat) | CDPL.ConfGen.TorsionCategory | |
addRule(TorsionRule rule) | CDPL.ConfGen.TorsionCategory | |
assign(TorsionLibrary lib) | CDPL.ConfGen.TorsionLibrary | |
CDPL::ConfGen::TorsionCategory.assign(TorsionCategory cat) | CDPL.ConfGen.TorsionCategory | |
bondAtom1Type (defined in CDPL.ConfGen.TorsionCategory) | CDPL.ConfGen.TorsionCategory | static |
bondAtom2Type (defined in CDPL.ConfGen.TorsionCategory) | CDPL.ConfGen.TorsionCategory | static |
categories (defined in CDPL.ConfGen.TorsionCategory) | CDPL.ConfGen.TorsionCategory | static |
clear() (defined in CDPL.ConfGen.TorsionCategory) | CDPL.ConfGen.TorsionCategory | |
get() | CDPL.ConfGen.TorsionLibrary | static |
getBondAtom1Type() | CDPL.ConfGen.TorsionCategory | |
getBondAtom2Type() | CDPL.ConfGen.TorsionCategory | |
getCategories() | CDPL.ConfGen.TorsionCategory | |
getCategory(int idx) | CDPL.ConfGen.TorsionCategory | |
getMatchPattern() | CDPL.ConfGen.TorsionCategory | |
getMatchPatternString() | CDPL.ConfGen.TorsionCategory | |
getName() | CDPL.ConfGen.TorsionCategory | |
getNumCategories(bool recursive=False) | CDPL.ConfGen.TorsionCategory | |
getNumRules(bool recursive=False) | CDPL.ConfGen.TorsionCategory | |
getObjectID() | CDPL.ConfGen.TorsionCategory | |
getRule(int idx) | CDPL.ConfGen.TorsionCategory | |
getRules() | CDPL.ConfGen.TorsionCategory | |
load(Base.IStream is) | CDPL.ConfGen.TorsionLibrary | |
loadDefaults() (defined in CDPL.ConfGen.TorsionLibrary) | CDPL.ConfGen.TorsionLibrary | |
matchPattern (defined in CDPL.ConfGen.TorsionCategory) | CDPL.ConfGen.TorsionCategory | static |
matchPatternString (defined in CDPL.ConfGen.TorsionCategory) | CDPL.ConfGen.TorsionCategory | static |
name (defined in CDPL.ConfGen.TorsionCategory) | CDPL.ConfGen.TorsionCategory | static |
numCategories (defined in CDPL.ConfGen.TorsionCategory) | CDPL.ConfGen.TorsionCategory | static |
numRules (defined in CDPL.ConfGen.TorsionCategory) | CDPL.ConfGen.TorsionCategory | static |
objectID (defined in CDPL.ConfGen.TorsionCategory) | CDPL.ConfGen.TorsionCategory | static |
removeCategory(int idx) | CDPL.ConfGen.TorsionCategory | |
removeRule(int idx) | CDPL.ConfGen.TorsionCategory | |
rules (defined in CDPL.ConfGen.TorsionCategory) | CDPL.ConfGen.TorsionCategory | static |
save(Base.OStream os) | CDPL.ConfGen.TorsionLibrary | |
set(TorsionLibrary map) | CDPL.ConfGen.TorsionLibrary | static |
setBondAtom1Type(int type) | CDPL.ConfGen.TorsionCategory | |
setBondAtom2Type(int type) | CDPL.ConfGen.TorsionCategory | |
setMatchPattern(Chem.MolecularGraph ptn) | CDPL.ConfGen.TorsionCategory | |
setMatchPatternString(str ptn_str) | CDPL.ConfGen.TorsionCategory | |
setName(str name) | CDPL.ConfGen.TorsionCategory | |
swap(TorsionCategory cat) | CDPL.ConfGen.TorsionCategory | |