Pauls-key-bindings-for-coot: Difference between revisions
No edit summary  | 
				mNo edit summary  | 
				||
| (5 intermediate revisions by the same user not shown) | |||
| Line 4: | Line 4: | ||
(add-key-binding "Refine Active Residue AA" "x" (lambda () (refine-active-residue)))  | (add-key-binding "Refine Active Residue AA" "x" (lambda () (refine-active-residue)))  | ||
(add-key-binding "Triple Refine" "t" (lambda () (manual-refine-residues 1)))  | (add-key-binding "Triple Refine" "t" (lambda () (manual-refine-residues 1)))  | ||
(add-key-binding "Autofit Rotamer" "j" (lambda () (auto-fit-rotamer-active-residue)))  | (add-key-binding "Autofit Rotamer" "j" (lambda () (auto-fit-rotamer-active-residue)))  | ||
(add-key-binding "Pepflip" "q" (lambda () (pepflip-active-residue)))  | (add-key-binding "Pepflip" "q" (lambda () (pepflip-active-residue)))  | ||
| Line 32: | Line 31: | ||
                                     (alt-conf  (list-ref active-atom 5)))  |                                      (alt-conf  (list-ref active-atom 5)))  | ||
                                 (fill-partial-residue imol chain-id res-no ins-code))))))  |                                  (fill-partial-residue imol chain-id res-no ins-code))))))  | ||
(add-key-binding "Kill Sidechain" "K"   | |||
   (lambda ()		   | |||
       (using-active-atom  | |||
	(delete-residue-sidechain aa-imol aa-chain-id aa-res-no aa-ins-code 0))))  | |||
(define *refine-residue-sphere-radius* 3.5) ;; Angstroms  | |||
(add-key-binding "Refine residues in a sphere" "R"  | |||
    (lambda ()  | |||
      (let ((active-atom (active-residue)))  | |||
        (if (not (list? active-atom))  | |||
            (format #t "No active atom~%")  | |||
            (let* ((centred-residue (list-head (cdr active-atom) 3))  | |||
                   (imol (car active-atom))  | |||
                   (other-residues (residues-near-residue imol centred-residue *refine-residue-sphere-radius*))  | |||
                   (all-residues (if (list? other-residues)  | |||
                                     (cons centred-residue other-residues)  | |||
                                     (list centred-residue))))  | |||
              (refine-residues imol all-residues))))))  | |||
(add-key-binding "Neighbours Refine" "h"  | |||
   (lambda ()       | |||
     (if (not (valid-map-molecule? (imol-refinement-map)))  | |||
	 (info-dialog "Must set the refinement map"))       | |||
     (using-active-atom        | |||
      (let* ((rc-spec (list aa-chain-id aa-res-no aa-ins-code))  | |||
	     (ls (residues-near-residue aa-imol rc-spec 1.9)))  | |||
	(with-auto-accept  | |||
	 (refine-residues aa-imol (cons rc-spec ls)))))))  | |||
(add-key-binding "Load RNAs files" "F9"    | (add-key-binding "Load RNAs files" "F9"    | ||
                  (lambda ()  |                   (lambda ()  | ||
| Line 56: | Line 88: | ||
                          (set-draw-ncs-ghosts keyboard-ghosts-mol 1)  |                           (set-draw-ncs-ghosts keyboard-ghosts-mol 1)  | ||
                          (set-draw-ncs-ghosts keyboard-ghosts-mol 0)))))  |                           (set-draw-ncs-ghosts keyboard-ghosts-mol 0)))))  | ||
(add-key-binding "Hydrogens off" "  | |||
(add-key-binding "Hydrogens off" "["  | |||
                  (lambda ()  |                   (lambda ()  | ||
                    (set-draw-hydrogens 0   |                    (let ((imol  | ||
(add-key-binding "Hydrogens on" "  |                           (let ((active-atom (active-residue)))  | ||
                            (if active-atom  | |||
                                (car active-atom)  | |||
                                0))))  | |||
                    (set-draw-hydrogens imol 0))))  | |||
(add-key-binding "Hydrogens on" "]"  | |||
                  (lambda ()  |                   (lambda ()  | ||
                    (set-draw-hydrogens   |                    (let ((imol  | ||
                          (let ((active-atom (active-residue)))  | |||
                            (if active-atom  | |||
                                (car active-atom)  | |||
                                0))))  | |||
                    (set-draw-hydrogens imol 1))))  | |||
(add-key-binding "Rotamer name in Status Bar" "~"    | (add-key-binding "Rotamer name in Status Bar" "~"    | ||
| Line 80: | Line 125: | ||
		       (add-status-bar-text "No name for this")  | 		       (add-status-bar-text "No name for this")  | ||
		       (add-status-bar-text (string-append "Rotamer name: " name))))))))))  | 		       (add-status-bar-text (string-append "Rotamer name: " name))))))))))  | ||
(add-key-binding "Regularize Residues" "B"   | |||
   (lambda ()  | |||
     (using-active-atom   | |||
      (regularize-zone aa-imol aa-chain-id (- aa-res-no 1) (+ aa-res-no 1) aa-alt-conf))))  | |||
(add-key-binding "Add Terminal Residue" "bar"   | |||
		 (lambda ()  | |||
		   (let ((active-atom (active-residue)))  | |||
		     (if (not active-atom)  | |||
			 (format #t "No active atom~%")  | |||
			 (let ((imol      (list-ref active-atom 0))  | |||
			       (chain-id  (list-ref active-atom 1))  | |||
			       (res-no    (list-ref active-atom 2))  | |||
			       (ins-code  (list-ref active-atom 3))  | |||
			       (atom-name (list-ref active-atom 4))  | |||
			       (alt-conf  (list-ref active-atom 5)))  | |||
			   (add-terminal-residue imol chain-id res-no "auto" 1))))))  | |||
(add-key-binding "Accept Baton Position" "quoteleft" accept-baton-position)  | |||
</pre>  | </pre>  | ||