5 #ifndef BALL_STRUCTURE_PEPTIDEBUILDER_H
6 #define BALL_STRUCTURE_PEPTIDEBUILDER_H
8 #ifndef BALL_STRUCTURE_PEPTIDES_H
50 void setAminoAcidType(
const String& type);
54 void setPhi(
const Angle& phi);
58 void setPsi(
const Angle& psi);
62 void setOmega(
const Angle& omega);
66 const String& getType()
const;
70 const Angle& getPhi()
const;
74 const Angle& getPsi()
const;
78 const Angle& getOmega()
const;
131 void setChainName(
const String& name);
135 const String& getChainName()
const;
139 void setProteinName(
const String& name);
143 const String& getProteinName()
const;
181 #endif // BALL_STRUCTURE_PEPTIDEBUILDER_H
std::vector< AminoAcidDescriptor > sequence_
FragmentDB * fragment_db_
-*- Mode: C++; tab-width: 2; -*-
bool is_proline_
The proline flag.