org-mode/contrib/lisp/ob-smiles.el
Nicolas Goaziou a486d9cbd7 Move link-related core functions out of "org.el"
* contrib/lisp/org-wl.el (org-wl-store-link-message):
* lisp/Makefile (clean-install):
* lisp/ob-core.el (org-link-bracket-re):
(org-babel-open-src-block-result):
(org-babel-read-element):
(org-babel-read-link):
(org-babel-result-end):
* lisp/ob-tangle.el (org-link-bracket-re):
(org-babel-tangle-single-block):
(org-link-analytic-bracket-re):
(org-babel-detangle):
(org-babel-tangle-jump-to-org):
* lisp/ol.el:
* lisp/org-agenda.el (org-agenda-get-some-entry-text):
(org-diary):
(org-agenda-format-item):
(org-agenda-open-link):
(org-agenda-switch-to):
(org-agenda-to-appt):
* lisp/org-bbdb.el (org-bbdb-store-link):
* lisp/org-bibtex.el (org-bibtex-store-link):
* lisp/org-capture.el (org-capture-fill-template):
* lisp/org-clock.el (org-clocktable-write-default):
(org-clock-get-table-data):
* lisp/org-compat.el (org-doi-server-url):
(org-email-link-description-format):
(org-make-link-description-function):
(org-from-is-user-regexp):
(org-descriptive-links):
(org-url-hexify-p):
(org-context-in-file-links):
(org-keep-stored-link-after-insertion):
(org-display-internal-link-with-indirect-buffer):
(org-confirm-shell-link-function):
(org-confirm-shell-link-not-regexp):
(org-confirm-elisp-link-function):
(org-confirm-elisp-link-not-regexp):
(org-file-complete-link):
(org-email-link-description):
(org-make-link-string):
(org-store-link-props):
(org-add-link-props):
(org-make-link-regexps):
(org-angle-link-re):
(org-plain-link-re):
(org-bracket-link-regexp):
(org-bracket-link-analytic-regexp):
(org-any-link-re):
* lisp/org-docview.el (org-docview-store-link):
(org-docview-complete-link):
* lisp/org-element.el (org-element-link-parser):
* lisp/org-eshell.el (org-eshell-store-link):
* lisp/org-eww.el (org-eww-store-link):
(org-eww-copy-for-org-mode):
* lisp/org-footnote.el (org-footnote-next-reference-or-definition):
* lisp/org-gnus.el (org-gnus-article-link):
(org-gnus-store-link):
* lisp/org-id.el (org-id-store-link):
* lisp/org-info.el (org-info-store-link):
* lisp/org-irc.el (org-irc-erc-store-link):
* lisp/org-mhe.el (org-mhe-store-link):
* lisp/org-pcomplete.el (pcomplete/org-mode/searchhead):
* lisp/org-protocol.el (org-protocol-do-capture):
* lisp/org-rmail.el (org-rmail-store-link):
* lisp/org-w3m.el (org-w3m-store-link):
(org-w3m-copy-for-org-mode):
2019-03-10 18:00:27 +01:00

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;;; ob-smiles.el --- Org-mode Babel support for SMILES.
;;; -*- coding: utf-8 -*-
;; Keywords: org babel SMILES
;; Version: 0.0.1
;; Package-Requires: ((smiles-mode "0.0.1") (org "8"))
;;; Commentary:
;;; I copy code from:
;;; http://kitchingroup.cheme.cmu.edu/blog/2016/03/26/A-molecule-link-for-org-mode
;; Author: John Kitchin [jkitchin@andrew.cmu.edu]
;; Maintainer: stardiviner [numbchild@gmail.com]
;;; Code:
;; Org-mode Babel
(defun org-babel-execute:smiles (body params)
"Execute SMILES babel `BODY' with `PARAMS'."
(shell-command-to-string
(format "obabel -:\"%s\" -osvg 2> /dev/null" body)))
;; Org-mode link
(defun molecule-jump (name)
"Jump to molecule `NAME' definition."
(org-mark-ring-push)
(org-link-open-from-string (format "[[%s]]" path)))
(defun molecule-export (path desc backend)
"Export molecule to HTML format on `PATH' with `DESC' and `BACKEND'."
(let ((name (save-window-excursion
(molecule-jump path)
(org-element-property :name (org-element-context)))))
(cond
((eq 'html backend)
(format "<a href=\"#%s\">%s</a>" name name)))))
(org-add-link-type
"molecule"
'molecule-jump
'molecule-export)
;; org-mode element
(org-element-map (org-element-parse-buffer)
'src-block
(lambda (src)
(when (string= "smiles" (org-element-property :language src))
(org-element-property :name src))))
(provide 'ob-smiles)
;;; ob-smiles.el ends here