version 1.2 | version 1.3 |
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class colvarbias_alb : public colvarbias { | class colvarbias_alb : public colvarbias { |
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public: | public: |
colvarbias_alb(std::string const &conf, char const *key); | |
virtual ~colvarbias_alb(); | |
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virtual cvm::real update(); | colvarbias_alb(char const *key); |
| virtual ~colvarbias_alb(); |
| virtual int init(std::string const &conf); |
| virtual int update(); |
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/// Read the bias configuration from a restart file | |
virtual std::istream & read_restart(std::istream &is); | virtual std::istream & read_restart(std::istream &is); |
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/// Write the bias configuration to a restart file | |
virtual std::ostream & write_restart(std::ostream &os); | virtual std::ostream & write_restart(std::ostream &os); |
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/// Write a label to the trajectory file (comment line) | |
virtual std::ostream & write_traj_label(std::ostream &os); | virtual std::ostream & write_traj_label(std::ostream &os); |
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/// Output quantities such as the bias energy to the trajectory file | |
virtual std::ostream & write_traj(std::ostream &os); | virtual std::ostream & write_traj(std::ostream &os); |
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protected: | protected: |