|
| | MakeRotLibJob (jd2::InnerJobOP inner_job, core::Size nstruct_index, core::Real omg, utility::vector1< core::Real > const &bbs, utility::vector1< core::Size > const &bb_ids, core::Real eps, MakeRotLibOptionsDataOP mrlod, bool semirotameric) |
| |
| | ~MakeRotLibJob () override=default |
| |
| core::Real | get_omg () const |
| | acessors More...
|
| |
| core::Real | get_bb (core::Size i) const |
| |
| utility::vector1< core::Real > | get_bbs () const |
| |
| utility::vector1< core::Size > | get_bb_ids () const |
| |
| core::Real | get_eps () const |
| |
| MakeRotLibOptionsDataOP | get_options_data () const |
| |
| bool | get_semirotameric () const |
| |
| | Job (InnerJobOP inner_job, core::Size nstruct_index) |
| |
| | Job (Job const &src) |
| | Copy constructor. More...
|
| |
| JobOP | copy_without_output () const |
| | returns a copy of this object whose "output fields" are zeroed out. Used by the JobDistributor in cases where the job fails and must be retried to prevent accumulation of Job state after a failure. This implementation was chosen over a clear_all_output function to prevent mover A from deleting mover B's hard work! You probably should not be trying to call this function. The exception: If you want an intermediate-output pose (not the final pose) to not have the aggregated accessory data in the "real" Job object. More...
|
| |
| JobOP | clone () const |
| | Return an owning pointer to a copy of this object. More...
|
| |
| | ~Job () override |
| |
| virtual void | show (std::ostream &out) const |
| |
| InnerJobCOP | inner_job () const |
| | access to inner-job ... use is discouraged - use sparingly! — DO NOT use my_job->inner_job()->get_pose() INSTEAD use my_job->get_pose() More...
|
| |
| std::string const & | input_tag () const |
| | return the input tag (a short string, generally) More...
|
| |
| InnerJobOP | inner_job_nonconst () |
| | nonconst access is intended only for the JobInputter to load poses into the InnerJob, and the Parser to add constraints, and the JobDistributor to delete completed inputs (recycle memory) More...
|
| |
| core::pose::PoseCOP | get_pose () const |
| | get_pose : will return More...
|
| |
| void | get_pose (core::pose::Pose &) const |
| | in-place copy of input pose More...
|
| |
| core::Size | nstruct_index () const |
| |
| core::Size | nstruct_max () const |
| |
| void | add_string (std::string const &string_in) |
| | add an output string More...
|
| |
| void | add_strings (Strings const &) |
| | add output strings More...
|
| |
| void | add_string_string_pair (std::string const &string1, std::string const &string2) |
| | add a string/string pair More...
|
| |
| void | add_string_real_pair (std::string const &string_in, core::Real const real_in) |
| | add a string/real pair More...
|
| |
| void | clear_output () |
| | Delete the output strings, string/string pairs, and string/real pairs. More...
|
| |
| Strings & | get_strings () |
| |
| StringStringPairs & | get_string_string_pairs () |
| |
| StringRealPairs & | get_string_real_pairs () |
| |
| Strings::const_iterator | output_strings_begin () const |
| |
| Strings::const_iterator | output_strings_end () const |
| |
| StringStringPairs::const_iterator | output_string_string_pairs_begin () const |
| |
| StringStringPairs::const_iterator | output_string_string_pairs_end () const |
| |
| StringRealPairs::const_iterator | output_string_real_pairs_begin () const |
| |
| StringRealPairs::const_iterator | output_string_real_pairs_end () const |
| |
| Strings | get_strings () const |
| |
| StringStringPairs | get_string_string_pairs () const |
| |
| StringRealPairs | get_string_real_pairs () const |
| |
| void | set_status_prefix (std::string prefix) |
| |
| std::string const & | status_prefix () const |
| |
| bool | completed () const |
| |
| bool | to_do () const |
| |
| bool | can_be_deleted () const |
| | Returns true iff this job can be deleted to free up memory. More...
|
| |
| bool | bad () const |
| |
| core::Size | start_time () const |
| |
| core::Size | end_time () const |
| |
| core::Size | elapsed_time () const |
| |
| std::string | timestamp () const |
| |
| void | set_completed (bool value=true) |
| |
| void | set_can_be_deleted (bool value=true) |
| | Set whether this job can be deleted to free up memory. More...
|
| |
| void | set_bad (bool value=true) |
| |
| void | start_timing () |
| |
| void | end_timing () |
| |
| void | add_output_observer (JobOutputterObserverAP an_observer) |
| |
| void | remove_output_observer (JobOutputterObserverAP old_observer) |
| |
| void | call_output_observers (core::pose::Pose const &pose) |
| |