{"id":5640,"date":"2020-03-12T14:34:21","date_gmt":"2020-03-12T14:34:21","guid":{"rendered":"https:\/\/loschmidt.chemi.muni.cz\/peg\/?p=5640"},"modified":"2020-03-12T14:34:21","modified_gmt":"2020-03-12T14:34:21","slug":"new-version-of-caverdock-released","status":"publish","type":"post","link":"https:\/\/loschmidt.chemi.muni.cz\/peg\/new-version-of-caverdock-released\/","title":{"rendered":"New Version of CaverDock Released"},"content":{"rendered":"\n<p class=\"wp-block-paragraph\"><a href=\"https:\/\/loschmidt.chemi.muni.cz\/caverdock\/\">CaverDock <\/a>1.1 has been released. <\/p>\n\n\n\n<p class=\"wp-block-paragraph\">Hopefully, the users will enjoy the new features:<\/p>\n\n\n\n<p class=\"wp-block-paragraph\"> &#8211; significantly improved heuristic for upper-bound computation, improved objective function<br>&#8211; multiple upper-bound trajectories are computed and saved<br>&#8211; script for automatic adding of flexible residues<br>&#8211; pattern restraint can be applied to selected ligand atoms only<br>&#8211; user can control how similar is the initial snapshot to the docklike<br>conformation<br>&#8211; CaverDock reports its execution settings<br>&#8211; improved parallel scaling of upper-bound computation <\/p>\n","protected":false},"excerpt":{"rendered":"<p>CaverDock 1.1 has been released. Hopefully, the users will enjoy the new features: &#8211; significantly improved heuristic for upper-bound computation, improved objective function&#8211; multiple upper-bound trajectories are computed and saved&#8211; script for automatic adding of flexible residues&#8211; pattern restraint can be applied to selected ligand atoms only&#8211; user can control how similar is the initial [&hellip;]<\/p>\n","protected":false},"author":4,"featured_media":0,"comment_status":"closed","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"ngg_post_thumbnail":0,"footnotes":""},"categories":[5],"tags":[],"class_list":["post-5640","post","type-post","status-publish","format-standard","hentry","category-news"],"_links":{"self":[{"href":"https:\/\/loschmidt.chemi.muni.cz\/peg\/wp-json\/wp\/v2\/posts\/5640","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/loschmidt.chemi.muni.cz\/peg\/wp-json\/wp\/v2\/posts"}],"about":[{"href":"https:\/\/loschmidt.chemi.muni.cz\/peg\/wp-json\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"https:\/\/loschmidt.chemi.muni.cz\/peg\/wp-json\/wp\/v2\/users\/4"}],"replies":[{"embeddable":true,"href":"https:\/\/loschmidt.chemi.muni.cz\/peg\/wp-json\/wp\/v2\/comments?post=5640"}],"version-history":[{"count":1,"href":"https:\/\/loschmidt.chemi.muni.cz\/peg\/wp-json\/wp\/v2\/posts\/5640\/revisions"}],"predecessor-version":[{"id":5641,"href":"https:\/\/loschmidt.chemi.muni.cz\/peg\/wp-json\/wp\/v2\/posts\/5640\/revisions\/5641"}],"wp:attachment":[{"href":"https:\/\/loschmidt.chemi.muni.cz\/peg\/wp-json\/wp\/v2\/media?parent=5640"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"https:\/\/loschmidt.chemi.muni.cz\/peg\/wp-json\/wp\/v2\/categories?post=5640"},{"taxonomy":"post_tag","embeddable":true,"href":"https:\/\/loschmidt.chemi.muni.cz\/peg\/wp-json\/wp\/v2\/tags?post=5640"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}