{"id":3682,"date":"2025-01-03T15:29:38","date_gmt":"2025-01-03T14:29:38","guid":{"rendered":"https:\/\/spgoo.org\/?page_id=3682"},"modified":"2025-01-19T18:39:31","modified_gmt":"2025-01-19T17:39:31","slug":"analyse-spgoo-aizynthfinder","status":"publish","type":"page","link":"https:\/\/spgoo.org\/?page_id=3682","title":{"rendered":"Analyse SPGoO &#8211; AiZynthFinder"},"content":{"rendered":"\n<link rel='stylesheet' id='3742-css'  href='https:\/\/spgoo.org\/wp-content\/uploads\/winp-css-js\/3742.css?ver=1737306906' type='text\/css' media='all' \/>\n\n\n<script src=\"https:\/\/cdn.jsdelivr.net\/npm\/katex\/dist\/katex.min.js\"><\/script>\r\n<link href=\"https:\/\/cdn.jsdelivr.net\/npm\/katex\/dist\/katex.min.css\" rel=\"stylesheet\">\r\n<script type=\"text\/javascript\" charset=\"UTF-8\" src=\"https:\/\/cdn.jsdelivr.net\/npm\/jsxgraph\/distrib\/jsxgraphcore.js\"><\/script>\r\n<link rel=\"stylesheet\" type=\"text\/css\" href=\"https:\/\/cdn.jsdelivr.net\/npm\/jsxgraph\/distrib\/jsxgraph.css\" \/>\r\n<script type=\"text\/javascript\" id=\"MathJax-script\" src=\"https:\/\/cdn.jsdelivr.net\/npm\/mathjax@3\/es5\/tex-mml-chtml.js\"> <\/script>\r\n<link id=\"themecss\" rel=\"stylesheet\" type=\"text\/css\" href=\"\/personnalisation\/shieldui\/css\/all.min.css\" \/>\r\n<script type=\"text\/javascript\" src=\"\/personnalisation\/shieldui\/js\/shieldui-all.min.js\"><\/script>\r\n<script>\r\n\twindow.WebFontConfig = {\r\n\t\tcustom: {\r\n\t\t\tfamilies: ['KaTeX_AMS', 'KaTeX_Caligraphic:n4,n7', 'KaTeX_Fraktur:n4,n7',\r\n\t\t\t\t\t   'KaTeX_Main:n4,n7,i4,i7', 'KaTeX_Math:i4,i7', 'KaTeX_Script',\r\n\t\t\t\t\t   'KaTeX_SansSerif:n4,n7,i4', 'KaTeX_Size1', 'KaTeX_Size2', 'KaTeX_Size3',\r\n\t\t\t\t\t   'KaTeX_Size4', 'KaTeX_Typewriter'],\r\n\t\t}\r\n\t};\r\n<\/script>\r\n\r\n<h1 style=\"text-align:center;\">Description technique du projet AiZynthFinder <\/h1>\r\n\r\n<div id=\"appli_objectif\">\r\n\t<h4>Objectifs<\/h4>\r\n\t<p>Obtenir la r\u00e9tro-synth\u00e8se d&#8217;une mol\u00e9cule \u00e0 partir de son SMILES.<\/p>\r\n\t\r\n<\/div>\r\n<div id=\"appli_structure\">\r\n\t<h4>Structure de l&#8217;application:<\/h4>\r\n\t<p>L&#8217;application s&#8217;organise autour de deux points d&#8217;entr\u00e9e aizynthcli ou aizynthapp. Le premier permet d&#8217;ex\u00e9cuter la r\u00e9solution en ligne de commande. Le deuxi\u00e8me point d&#8217;entr\u00e9e permet d&#8217;ex\u00e9cuter un jupyter notebook pour mettre l&#8217;utilisateur dans ce contexte. Pour ex\u00e9cuter, il vous suffit d&#8217;installer l&#8217;ensemble du <a href=\"https:\/\/github.com\/MolecularAI\/aizynthfinder\">github<\/a>  ou r\u00e9cup\u00e9rer l&#8217;image docker (d\u00e9p\u00f4t \u00e0 situer ??).\r\n\t<\/p>\r\n<\/div>\r\n<hr\/>\r\n<div id=\"appli_arborescence\" style=\"width:100%\">\r\n\t<div class=\"row\" id=\"container_splitter\">\r\n\t\t<div class=\"col-sm-6\">\r\n\t\t\t<h4>Description de l\u2019arborescence :<\/h4>\r\n\t\t\t<div class=\"fen_arrondie\" id=\"desc_arbo\" style=\"background-color:grey;\" >\r\n\t\t\t<\/div>\r\n\t\t<\/div>\r\n\t\t\r\n\t\t<div class=\"col-sm-6\" class=\"fen_arrondie\" >\r\n\t\t\t <h4>Description rapide du fichier<\/h4>\r\n\t\t\t<div class=\"row\">\r\n\t\t\t\t<div class=\"col-sm-12\" style=\"overflow:auto;\">\r\n\t\t\t\t\t<div id=\"info_rapide_file\" style=\"color:lightblue;width:800px;\"><\/div>\t\r\n\t\t\t\t<\/div>\r\n\t\t\t<\/div>\r\n\t\t\t<div class=\"row\">\r\n\t\t\t\t<div class=\"col-sm-12\">\r\n\t\t\t\t\t<div id=\"grid_classes\" class=\"grid-classes\"><\/div>\t\r\n\t\t\t\t<\/div>\r\n\t\t\t<\/div>\r\n\t\t<\/div>\r\n\t\t\r\n<\/div>\r\n<hr\/>\r\n<h4>D\u00e9tails fichier :<\/h4>\r\n<hr\/>\r\n<h4>D\u00e9tails R\u00e9sultats :<\/h4>\r\n\t<div id=\"zone_resultats\" style=\"color:lightblue;\"><\/div>\r\n\t\r\n\n\n<script type='text\/javascript'>\nvar id = \"3685\";<\/script>\n<script type='text\/javascript' src='https:\/\/spgoo.org\/wp-content\/uploads\/winp-css-js\/3685.js?ver=1737382758'><\/script>\n\n\n<script type='text\/javascript'>\nvar id = \"4167\";<\/script>\n<script type='text\/javascript' src='https:\/\/spgoo.org\/wp-content\/uploads\/winp-css-js\/4167.js?ver=1736242889'><\/script>\n\n\n\n<p><\/p>\n","protected":false},"excerpt":{"rendered":"","protected":false},"author":1,"featured_media":0,"parent":0,"menu_order":0,"comment_status":"closed","ping_status":"closed","template":"","meta":{"footnotes":""},"class_list":["post-3682","page","type-page","status-publish","hentry"],"_links":{"self":[{"href":"https:\/\/spgoo.org\/index.php?rest_route=\/wp\/v2\/pages\/3682","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/spgoo.org\/index.php?rest_route=\/wp\/v2\/pages"}],"about":[{"href":"https:\/\/spgoo.org\/index.php?rest_route=\/wp\/v2\/types\/page"}],"author":[{"embeddable":true,"href":"https:\/\/spgoo.org\/index.php?rest_route=\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"https:\/\/spgoo.org\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=3682"}],"version-history":[{"count":10,"href":"https:\/\/spgoo.org\/index.php?rest_route=\/wp\/v2\/pages\/3682\/revisions"}],"predecessor-version":[{"id":4734,"href":"https:\/\/spgoo.org\/index.php?rest_route=\/wp\/v2\/pages\/3682\/revisions\/4734"}],"wp:attachment":[{"href":"https:\/\/spgoo.org\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=3682"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}