{"id":207,"date":"2023-07-02T13:07:34","date_gmt":"2023-07-02T13:07:34","guid":{"rendered":"https:\/\/bioinformatika-egy.com\/?p=207"},"modified":"2023-07-03T14:39:41","modified_gmt":"2023-07-03T14:39:41","slug":"%d8%a7%d9%84%d9%81%d8%ad%d8%b5-%d8%a7%d9%84%d9%87%d9%8a%d9%83%d9%84%d9%8a-%d9%84%d9%84%d8%b1%d9%88%d8%a8%d8%b1%d9%88%d9%85%d8%a7%d9%8a%d8%b3%d9%8a%d9%86","status":"publish","type":"post","link":"https:\/\/bioinformatika-egy.com\/?p=207","title":{"rendered":"\u0627\u0644\u0641\u062d\u0635 \u0627\u0644\u0647\u064a\u0643\u0644\u064a \u0644\u0644\u0631\u0648\u0628\u0631\u0648\u0645\u0627\u064a\u0633\u064a\u0646"},"content":{"rendered":"\t\t<div data-elementor-type=\"wp-post\" data-elementor-id=\"207\" class=\"elementor elementor-207\" data-elementor-settings=\"{&quot;element_pack_global_tooltip_width&quot;:{&quot;unit&quot;:&quot;px&quot;,&quot;size&quot;:&quot;&quot;,&quot;sizes&quot;:[]},&quot;element_pack_global_tooltip_width_tablet&quot;:{&quot;unit&quot;:&quot;px&quot;,&quot;size&quot;:&quot;&quot;,&quot;sizes&quot;:[]},&quot;element_pack_global_tooltip_width_mobile&quot;:{&quot;unit&quot;:&quot;px&quot;,&quot;size&quot;:&quot;&quot;,&quot;sizes&quot;:[]},&quot;element_pack_global_tooltip_padding&quot;:{&quot;unit&quot;:&quot;px&quot;,&quot;top&quot;:&quot;&quot;,&quot;right&quot;:&quot;&quot;,&quot;bottom&quot;:&quot;&quot;,&quot;left&quot;:&quot;&quot;,&quot;isLinked&quot;:true},&quot;element_pack_global_tooltip_padding_tablet&quot;:{&quot;unit&quot;:&quot;px&quot;,&quot;top&quot;:&quot;&quot;,&quot;right&quot;:&quot;&quot;,&quot;bottom&quot;:&quot;&quot;,&quot;left&quot;:&quot;&quot;,&quot;isLinked&quot;:true},&quot;element_pack_global_tooltip_padding_mobile&quot;:{&quot;unit&quot;:&quot;px&quot;,&quot;top&quot;:&quot;&quot;,&quot;right&quot;:&quot;&quot;,&quot;bottom&quot;:&quot;&quot;,&quot;left&quot;:&quot;&quot;,&quot;isLinked&quot;:true},&quot;element_pack_global_tooltip_border_radius&quot;:{&quot;unit&quot;:&quot;px&quot;,&quot;top&quot;:&quot;&quot;,&quot;right&quot;:&quot;&quot;,&quot;bottom&quot;:&quot;&quot;,&quot;left&quot;:&quot;&quot;,&quot;isLinked&quot;:true},&quot;element_pack_global_tooltip_border_radius_tablet&quot;:{&quot;unit&quot;:&quot;px&quot;,&quot;top&quot;:&quot;&quot;,&quot;right&quot;:&quot;&quot;,&quot;bottom&quot;:&quot;&quot;,&quot;left&quot;:&quot;&quot;,&quot;isLinked&quot;:true},&quot;element_pack_global_tooltip_border_radius_mobile&quot;:{&quot;unit&quot;:&quot;px&quot;,&quot;top&quot;:&quot;&quot;,&quot;right&quot;:&quot;&quot;,&quot;bottom&quot;:&quot;&quot;,&quot;left&quot;:&quot;&quot;,&quot;isLinked&quot;:true}}\">\n\t\t\t\t<div class=\"elementor-element elementor-element-701c409 e-flex e-con-boxed e-con e-parent\" data-id=\"701c409\" data-element_type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t<div class=\"elementor-element elementor-element-179f1c1 e-flex e-con-boxed e-con e-parent\" data-id=\"179f1c1\" data-element_type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-afafc7c elementor-widget elementor-widget-image\" data-id=\"afafc7c\" data-element_type=\"widget\" data-widget_type=\"image.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t<img decoding=\"async\" src=\"https:\/\/bioinformatika-egy.com\/wp-content\/uploads\/elementor\/thumbs\/2-qwspyurd7yetq3eucycss9uk4hcmmrsfj6mlbwhhvc.jpg\" title=\"\" alt=\"\" loading=\"lazy\" \/>\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-aaff042 elementor-widget elementor-widget-text-editor\" data-id=\"aaff042\" data-element_type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<p><strong>\u0645\u062d\u0627\u0643\u0627\u0629 \u0627\u0631\u062a\u0628\u0627\u0637 \u0645\u062b\u0628\u0637 \u0644\u0644\u0628\u0631\u0648\u062a\u064a\u0646 \u0627\u0644\u0628\u0631\u0648\u062a\u064a\u0627\u0632 \u0627\u0644\u0631\u0626\u064a\u0633\u064a \u0627\u0644\u062e\u0627\u0635 \u0628\u0641\u064a\u0631\u0648\u0633 \u0627\u0644\u0643\u0648\u0631\u0648\u0646\u0627<\/strong><\/p><p><strong>\u0628\u0631\u0648\u062a\u064a\u0646 \u0627\u0644\u0628\u0631\u0648\u062a\u064a\u0627\u0632 \u0627\u0644\u0631\u0626\u064a\u0633\u064a \u0647\u0648 \u0627\u062d\u062f \u0627\u0644\u0628\u0631\u0648\u062a\u064a\u0646\u0627\u062a \u0627\u0644\u0648\u0638\u064a\u0641\u064a\u0629 \u0627\u0644\u0623\u0633\u0627\u0633\u064a\u0629 \u0641\u064a \u0641\u064a\u0631\u0648\u0633 \u0627\u0644\u0643\u0648\u0631\u0648\u0646\u0627 \u0648\u062a\u062b\u0628\u064a\u0637\u0647 \u064a\u0639\u0646\u064a \u0627\u0644\u0642\u0636\u0627\u0621 \u0639\u0644\u0649 \u0627\u0644\u0641\u064a\u0631\u0648\u0633 \u062f\u0627\u062e\u0644 \u062e\u0644\u064a\u0629 \u0627\u0644\u0639\u0627\u0626\u0644. \u0644\u0630\u0627 \u0634\u0631\u0639\u0646\u0627 \u0641\u064a \u0647\u0630\u0627 \u0627\u0644\u0645\u0634\u0631\u0648\u0639 \u0639\u0644\u0649 \u0627\u064a\u062c\u0627\u062f \u0645\u062b\u0628\u0637 \u0642\u0648\u064a \u0644\u0647\u0630\u0627 \u0627\u0644\u0628\u0631\u0648\u062a\u064a\u0646 \u0645\u0646 \u0628\u064a\u0646 \u0645\u0643\u062a\u0628\u0629 \u0645\u0646 \u0627\u0644\u0645\u0631\u0643\u0628\u0627\u062a \u0630\u0627\u062a \u0627\u0644\u0634\u0643\u0644 \u0627\u0644\u0641\u0631\u0627\u063a\u064a \u0627\u0644\u0641\u0631\u064a\u062f (<\/strong><strong>(Atropisomers<\/strong><strong>. \u0628\u0639\u062f \u062a\u0637\u0628\u064a\u0642 \u0639\u062f\u062f \u0645\u0646 \u0627\u0644\u062a\u062c\u0627\u0631\u0628 \u0627\u0644\u062d\u0633\u0627\u0628\u064a\u0629 \u0648 \u0627\u0644\u0645\u0639\u0645\u0644\u064a\u0629 \u062d\u062f\u062f\u0646\u0627 \u0623\u062d\u062f \u0627\u0644\u0645\u0631\u0643\u0628\u0627\u062a \u0627\u0644\u0648\u0627\u0639\u062f\u0629\u060c \u0648 \u0645\u0646 \u062e\u0644\u0627\u0644 \u062a\u0637\u0628\u064a\u0642 \u0645\u062d\u0627\u0643\u0627\u0629 \u062c\u0627\u0648\u0632\u064a\u0627\u0646\u060c \u0642\u0645\u0646\u0627 \u0628\u0627\u0644\u0643\u0634\u0641 \u0639\u0646 \u0622\u0644\u064a\u0629 \u0627\u0631\u062a\u0628\u0627\u0637 \u0647\u0630\u0627 \u0627\u0644\u0645\u0631\u0643\u0628 \u0628\u0627\u0644\u0645\u0648\u0642\u0639 \u0627\u0644\u0646\u0634\u0637 \u0639\u0644\u0649 \u0628\u0631\u0648\u062a\u064a\u0646 \u0627\u0644\u0628\u0631\u0648\u062a\u064a\u0627\u0632 \u0627\u0644\u0631\u0626\u064a\u0633\u064a.<\/strong><\/p><p><strong>\u062a\u0641\u0627\u0635\u064a\u0644 \u0627\u0644\u0645\u0634\u0631\u0648\u0639 \u062a\u062c\u062f\u0647\u0627 \u0641\u064a \u0627\u0644\u0648\u0631\u0642\u0629 \u0627\u0644\u0628\u062d\u062b\u064a\u0629 \u0627\u0644\u062a\u0627\u0644\u064a\u0629:<\/strong><\/p><p><a href=\"https:\/\/www.sciencedirect.com\/science\/article\/abs\/pii\/S0223523422005311\"><strong>https:\/\/www.sciencedirect.com\/science\/article\/abs\/pii\/S0223523422005311<\/strong><\/a><\/p><p><strong>\u0641\u064a\u062f\u064a\u0648 \u062a\u0648\u0636\u064a\u062d\u064a \u0644\u0627\u0647\u0645 \u0646\u062a\u0627\u0626\u062c \u0627\u0644\u0628\u062d\u062b:<\/strong><\/p><p><a href=\"https:\/\/fb.watch\/luM38DijJx\/\"><strong>https:\/\/fb.watch\/luM38DijJx\/<\/strong><\/a><\/p>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-dc740fb elementor-widget elementor-widget-text-editor\" data-id=\"dc740fb\" data-element_type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<p><strong>Exploring the binding process of an inhibitor to the SARS CoV-2\u2019s main protease (M<sup>pro<\/sup>)<\/strong><\/p><p><strong>The main protease protein is one of the basic functional proteins in the coronaviruses, and inhibiting it means eliminating the virus inside the host cell. So, we set out in this project to find a strong inhibitor of this protein from among a library of compounds with a unique stereoscopic shape (Atropisomers). After applying a number of computational and laboratory experiments, we identified one of the promising compounds, and by applying Gaussian accelerated simulations, we revealed the mechanism of association of this compound to the active site of M<sup>pro<\/sup><\/strong><strong>.<\/strong><\/p><p><strong>Project details can be found in the following research paper<\/strong><strong>:<\/strong><\/p><p><a href=\"https:\/\/www.sciencedirect.com\/science\/article\/abs\/pii\/S0223523422005311\"><strong>https:\/\/www.sciencedirect.com\/science\/article\/abs\/pii\/S0223523422005311<\/strong><\/a><\/p><p><strong>An illustrative video can be found here:<\/strong><\/p><p><a href=\"https:\/\/fb.watch\/luM38DijJx\/\"><strong>https:\/\/fb.watch\/luM38DijJx\/<\/strong><\/a><\/p>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t","protected":false},"excerpt":{"rendered":"<p>\u0645\u062d\u0627\u0643\u0627\u0629 \u0627\u0631\u062a\u0628\u0627\u0637 \u0645\u062b\u0628\u0637 \u0644\u0644\u0628\u0631\u0648\u062a\u064a\u0646 \u0627\u0644\u0628\u0631\u0648\u062a\u064a\u0627\u0632 \u0627\u0644\u0631\u0626\u064a\u0633\u064a \u0627\u0644\u062e\u0627\u0635 \u0628\u0641\u064a\u0631\u0648\u0633 \u0627\u0644\u0643\u0648\u0631\u0648\u0646\u0627 \u0628\u0631\u0648\u062a\u064a\u0646 \u0627\u0644\u0628\u0631\u0648\u062a\u064a\u0627\u0632 \u0627\u0644\u0631\u0626\u064a\u0633\u064a \u0647\u0648 \u0627\u062d\u062f \u0627\u0644\u0628\u0631\u0648\u062a\u064a\u0646\u0627\u062a \u0627\u0644\u0648\u0638\u064a\u0641\u064a\u0629 \u0627\u0644\u0623\u0633\u0627\u0633\u064a\u0629 \u0641\u064a \u0641\u064a\u0631\u0648\u0633 \u0627\u0644\u0643\u0648\u0631\u0648\u0646\u0627 \u0648\u062a\u062b\u0628\u064a\u0637\u0647 \u064a\u0639\u0646\u064a \u0627\u0644\u0642\u0636\u0627\u0621 \u0639\u0644\u0649 \u0627\u0644\u0641\u064a\u0631\u0648\u0633 \u062f\u0627\u062e\u0644 \u062e\u0644\u064a\u0629 \u0627\u0644\u0639\u0627\u0626\u0644. \u0644\u0630\u0627 \u0634\u0631\u0639\u0646\u0627 \u0641\u064a \u0647\u0630\u0627 \u0627\u0644\u0645\u0634\u0631\u0648\u0639 \u0639\u0644\u0649 \u0627\u064a\u062c\u0627\u062f \u0645\u062b\u0628\u0637 \u0642\u0648\u064a \u0644\u0647\u0630\u0627 \u0627\u0644\u0628\u0631\u0648\u062a\u064a\u0646 \u0645\u0646 \u0628\u064a\u0646 \u0645\u0643\u062a\u0628\u0629 \u0645\u0646 \u0627\u0644\u0645\u0631\u0643\u0628\u0627\u062a \u0630\u0627\u062a \u0627\u0644\u0634\u0643\u0644 \u0627\u0644\u0641\u0631\u0627\u063a\u064a \u0627\u0644\u0641\u0631\u064a\u062f ((Atropisomers. \u0628\u0639\u062f \u062a\u0637\u0628\u064a\u0642 \u0639\u062f\u062f \u0645\u0646 \u0627\u0644\u062a\u062c\u0627\u0631\u0628 \u0627\u0644\u062d\u0633\u0627\u0628\u064a\u0629 [&hellip;]<\/p>\n","protected":false},"author":1,"featured_media":0,"comment_status":"open","ping_status":"open","sticky":false,"template":"elementor_header_footer","format":"standard","meta":{"footnotes":""},"categories":[5],"tags":[],"class_list":["post-207","post","type-post","status-publish","format-standard","hentry","category-5"],"_links":{"self":[{"href":"https:\/\/bioinformatika-egy.com\/index.php?rest_route=\/wp\/v2\/posts\/207","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/bioinformatika-egy.com\/index.php?rest_route=\/wp\/v2\/posts"}],"about":[{"href":"https:\/\/bioinformatika-egy.com\/index.php?rest_route=\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"https:\/\/bioinformatika-egy.com\/index.php?rest_route=\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"https:\/\/bioinformatika-egy.com\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=207"}],"version-history":[{"count":4,"href":"https:\/\/bioinformatika-egy.com\/index.php?rest_route=\/wp\/v2\/posts\/207\/revisions"}],"predecessor-version":[{"id":211,"href":"https:\/\/bioinformatika-egy.com\/index.php?rest_route=\/wp\/v2\/posts\/207\/revisions\/211"}],"wp:attachment":[{"href":"https:\/\/bioinformatika-egy.com\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=207"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"https:\/\/bioinformatika-egy.com\/index.php?rest_route=%2Fwp%2Fv2%2Fcategories&post=207"},{"taxonomy":"post_tag","embeddable":true,"href":"https:\/\/bioinformatika-egy.com\/index.php?rest_route=%2Fwp%2Fv2%2Ftags&post=207"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}