{"id":36601,"date":"2025-01-14T20:00:10","date_gmt":"2025-01-14T12:00:10","guid":{"rendered":"https:\/\/17aitech.com\/?p=36601"},"modified":"2025-01-14T20:00:10","modified_gmt":"2025-01-14T12:00:10","slug":"%e6%94%b9%e8%bf%9b%e8%9b%8b%e7%99%bd%e7%aa%81%e5%8f%98%e7%a8%b3%e5%ae%9a%e6%80%a7%e9%a2%84%e6%b5%8b%ef%bc%8c%e6%b8%85%e5%8d%8e%e9%be%9a%e6%b5%b7%e9%b9%8f%e5%9b%a2%e9%98%9fai%e8%9b%8b%e7%99%bd%e5%b7%a5","status":"publish","type":"post","link":"https:\/\/17aitech.com\/?p=36601","title":{"rendered":"\u6539\u8fdb\u86cb\u767d\u7a81\u53d8\u7a33\u5b9a\u6027\u9884\u6d4b\uff0c\u6e05\u534e\u9f9a\u6d77\u9e4f\u56e2\u961fAI\u86cb\u767d\u5de5\u7a0b\u6a21\u578b\u767bNature\u5b50\u520a"},"content":{"rendered":"<p>\u6587\u7ae0\u6765\u6e90\u4e8e\u4e92\u8054\u7f51:<a href=\"https:\/\/www.jiqizhixin.com\/articles\/2024-11-11-8\" target=\"_blank\">\u6539\u8fdb\u86cb\u767d\u7a81\u53d8\u7a33\u5b9a\u6027\u9884\u6d4b\uff0c\u6e05\u534e\u9f9a\u6d77\u9e4f\u56e2\u961fAI\u86cb\u767d\u5de5\u7a0b\u6a21\u578b\u767bNature\u5b50\u520a<\/a><\/p>\n<section><a href=\"https:\/\/17aitech.com\/wp-content\/uploads\/2024\/11\/frc-54a56e72d9c96f7eccd3d59340f2074a.jpeg\" data-fancybox=\"images\" data-fancybox=\"gallery\"><img decoding=\"async\" src=\"https:\/\/17aitech.com\/wp-content\/uploads\/2024\/11\/frc-54a56e72d9c96f7eccd3d59340f2074a.jpeg\"><\/a><\/section>\n<p>\u7f16\u8f91 | KX<\/p>\n<p>\u51c6\u786e\u9884\u6d4b\u86cb\u767d\u8d28\u7a81\u53d8\u6548\u5e94\u5728\u86cb\u767d\u8d28\u5de5\u7a0b\u548c\u8bbe\u8ba1\u4e2d\u81f3\u5173\u91cd\u8981\u3002<\/p>\n<p>\u8fd1\u65e5\uff0c\u6e05\u534e\u5927\u5b66\u9f9a\u6d77\u9e4f\u56e2\u961f\u63d0\u51fa\u4e86\u4e00\u5957\u57fa\u4e8e\u51e0\u4f55\u5b66\u4e60\u7684\u6a21\u578b\u5957\u4ef6\u2014\u2014GeoStab-suite\uff0c\u5176\u4e2d\u5305\u542b GeoFitness\u3001GeoDDG \u548c GeoDTm \u4e09\u4e2a\u6a21\u578b\uff0c\u5206\u522b\u7528\u4e8e\u9884\u6d4b\u86cb\u767d\u8d28\u7a81\u53d8\u540e\u7684\u9002\u5e94\u5ea6\u5f97\u5206\u3001\u0394\u0394G \u548c \u0394Tm\u3002<\/p>\n<p>GeoFitness \u91c7\u7528\u4e13\u95e8\u7684\u635f\u5931\u51fd\u6570\uff0c\u5141\u8bb8\u4f7f\u7528\u6df1\u5ea6\u7a81\u53d8\u626b\u63cf\u6570\u636e\u5e93\u4e2d\u7684\u5927\u91cf\u591a\u6807\u8bb0\u9002\u5e94\u5ea6\u6570\u636e\u5bf9\u7edf\u4e00\u6a21\u578b\u8fdb\u884c\u76d1\u7763\u8bad\u7ec3\u3002\u4e3a\u4e86\u8fdb\u4e00\u6b65\u6539\u8fdb \u0394\u0394G \u548c \u0394Tm \u9884\u6d4b\u7684\u4e0b\u6e38\u4efb\u52a1\uff0cGeoFitness \u7684\u7f16\u7801\u5668\u88ab\u91cd\u65b0\u7528\u4f5c GeoDDG \u548c GeoDTm \u4e2d\u7684\u9884\u8bad\u7ec3\u6a21\u5757\uff0c\u6765\u514b\u670d\u7f3a\u4e4f\u8db3\u591f\u6807\u8bb0\u6570\u636e\u7684\u6311\u6218\u3002<\/p>\n<p>\u8fd9\u79cd\u9884\u8bad\u7ec3\u7b56\u7565\u4e0e\u6570\u636e\u6269\u5c55\u76f8\u7ed3\u5408\uff0c\u663e\u8457\u63d0\u9ad8\u4e86\u6a21\u578b\u6027\u80fd\u548c\u901a\u7528\u6027\u3002<\/p>\n<p>\u5728\u57fa\u51c6\u6d4b\u8bd5\u4e2d\uff0c\u5c31 Spearman \u76f8\u5173\u7cfb\u6570\u800c\u8a00\uff0cGeoDDG \u548c GeoDTm \u5206\u522b\u6bd4\u5176\u4ed6\u6700\u5148\u8fdb\u7684\u65b9\u6cd5\u9ad8\u51fa\u81f3\u5c11 30% \u548c 70%\u3002<\/p>\n<p>\u76f8\u5173\u7814\u7a76\u4ee5\u300c<em>Improving the prediction of protein stability changes upon mutations by geometric learning and a pre-training strategy<\/em>\u300d\u4e3a\u9898\uff0c\u4e8e 10 \u6708 25 \u65e5\u53d1\u8868\u5728\u300a<em>Nature Computational Science<\/em>\u300b\u4e0a\u3002<\/p>\n<p><a href=\"https:\/\/17aitech.com\/wp-content\/uploads\/2024\/11\/frc-89a4ce30659827765b3d2ccce2670ba9.png\" data-fancybox=\"images\" data-fancybox=\"gallery\"><img decoding=\"async\" src=\"https:\/\/17aitech.com\/wp-content\/uploads\/2024\/11\/frc-89a4ce30659827765b3d2ccce2670ba9.png\"><\/a><\/p>\n<p>\u8bba\u6587\u94fe\u63a5\uff1a<em>https:\/\/www.nature.com\/articles\/s43588-024-00716-2<\/em><\/p>\n<div id=\"ez-toc-container\" class=\"ez-toc-v2_0_78 ez-toc-wrap-left-text counter-hierarchy ez-toc-counter ez-toc-light-blue ez-toc-container-direction\">\n<div class=\"ez-toc-title-container\">\n<p class=\"ez-toc-title\" style=\"cursor:inherit\">\u6587\u7ae0\u76ee\u5f55<\/p>\n<span class=\"ez-toc-title-toggle\"><a href=\"#\" class=\"ez-toc-pull-right ez-toc-btn ez-toc-btn-xs ez-toc-btn-default ez-toc-toggle\" aria-label=\"Toggle Table of Content\"><span class=\"ez-toc-js-icon-con\"><span class=\"\"><span class=\"eztoc-hide\" style=\"display:none;\">Toggle<\/span><span class=\"ez-toc-icon-toggle-span\"><svg style=\"fill: #999;color:#999\" xmlns=\"http:\/\/www.w3.org\/2000\/svg\" class=\"list-377408\" width=\"20px\" height=\"20px\" viewBox=\"0 0 24 24\" fill=\"none\"><path d=\"M6 6H4v2h2V6zm14 0H8v2h12V6zM4 11h2v2H4v-2zm16 0H8v2h12v-2zM4 16h2v2H4v-2zm16 0H8v2h12v-2z\" fill=\"currentColor\"><\/path><\/svg><svg style=\"fill: #999;color:#999\" class=\"arrow-unsorted-368013\" xmlns=\"http:\/\/www.w3.org\/2000\/svg\" width=\"10px\" height=\"10px\" viewBox=\"0 0 24 24\" version=\"1.2\" baseProfile=\"tiny\"><path d=\"M18.2 9.3l-6.2-6.3-6.2 6.3c-.2.2-.3.4-.3.7s.1.5.3.7c.2.2.4.3.7.3h11c.3 0 .5-.1.7-.3.2-.2.3-.5.3-.7s-.1-.5-.3-.7zM5.8 14.7l6.2 6.3 6.2-6.3c.2-.2.3-.5.3-.7s-.1-.5-.3-.7c-.2-.2-.4-.3-.7-.3h-11c-.3 0-.5.1-.7.3-.2.2-.3.5-.3.7s.1.5.3.7z\"\/><\/svg><\/span><\/span><\/span><\/a><\/span><\/div>\n<nav><ul class='ez-toc-list ez-toc-list-level-1 ' ><li class='ez-toc-page-1 ez-toc-heading-level-1'><a class=\"ez-toc-link ez-toc-heading-1\" href=\"https:\/\/17aitech.com\/?p=36601\/#%E8%9B%8B%E7%99%BD%E8%B4%A8%E8%AE%BE%E8%AE%A1\" >\u86cb\u767d\u8d28\u8bbe\u8ba1<\/a><\/li><li class='ez-toc-page-1 ez-toc-heading-level-1'><a class=\"ez-toc-link ez-toc-heading-2\" href=\"https:\/\/17aitech.com\/?p=36601\/#%E5%9F%BA%E4%BA%8E%E5%87%A0%E4%BD%95%E5%AD%A6%E4%B9%A0%E7%9A%84%E4%B8%89%E4%B8%AA%E6%A8%A1%E5%9E%8B\" >\u57fa\u4e8e\u51e0\u4f55\u5b66\u4e60\u7684\u4e09\u4e2a\u6a21\u578b<\/a><\/li><\/ul><\/nav><\/div>\n<h1><span class=\"ez-toc-section\" id=\"%E8%9B%8B%E7%99%BD%E8%B4%A8%E8%AE%BE%E8%AE%A1\"><\/span><strong>\u86cb\u767d\u8d28\u8bbe\u8ba1<\/strong><span class=\"ez-toc-section-end\"><\/span><\/h1>\n<p>\u86cb\u767d\u8d28\u9002\u5e94\u5ea6\u662f\u6307\u86cb\u767d\u8d28\u53d1\u6325\u7279\u5b9a\u529f\u80fd\u7684\u80fd\u529b\uff0c\u4f46\u5728\u4e0d\u540c\u7684\u5b9e\u9a8c\u60c5\u51b5\u4e0b\uff0c\u901a\u5e38\u7528\u4e0d\u540c\u7684\u6307\u6807\u6765\u91cf\u5316\uff0c\u4f8b\u5982\u9176\u6d3b\u6027\u3001\u80bd\u7ed3\u5408\u4eb2\u548c\u529b\u548c\u86cb\u767d\u8d28\u7a33\u5b9a\u6027\u3002\u86cb\u767d\u8d28\u8bbe\u8ba1\u548c\u5de5\u7a0b\u7684\u4e3b\u8981\u76ee\u6807\u4e4b\u4e00\u662f\u63d0\u9ad8\u86cb\u767d\u8d28\u9002\u5e94\u5ea6\uff0c\u4ece\u800c\u63d0\u9ad8\u751f\u7269\u6280\u672f\u548c\u751f\u7269\u5236\u836f\u8fc7\u7a0b\u4e2d\u7684\u86cb\u767d\u8d28\u6027\u80fd\u3002<\/p>\n<p>\u5728\u5404\u79cd\u86cb\u767d\u8d28\u9002\u5e94\u5ea6\u6307\u6807\u4e2d\uff0c\u86cb\u767d\u8d28\u7a33\u5b9a\u6027\u5907\u53d7\u5173\u6ce8\uff0c\u901a\u5e38\u7528 \u0394G \u548c Tm \u4e24\u4e2a\u6307\u6807\u6765\u8bc4\u4f30\u3002\u0394G \u8868\u793a\u5ba4\u6e29\u4e0b\u5c55\u5f00\u81ea\u7531\u80fd\u53d8\u5316\uff0c\u63cf\u8ff0\u86cb\u767d\u8d28\u7684\u70ed\u529b\u5b66\u7a33\u5b9a\u6027\uff1bTm \u4ee3\u8868\u86cb\u767d\u8d28\u7194\u5316\u6e29\u5ea6\uff0c\u53cd\u6620\u86cb\u767d\u8d28\u5728\u6e29\u5ea6\u6ce2\u52a8\u4e0b\u4fdd\u6301\u6298\u53e0\u72b6\u6001\u7684\u80fd\u529b\u3002<\/p>\n<p><a href=\"https:\/\/17aitech.com\/wp-content\/uploads\/2024\/11\/frc-066b367482b31984e861abc85b43e23c.png\" data-fancybox=\"images\" data-fancybox=\"gallery\"><img decoding=\"async\" src=\"https:\/\/17aitech.com\/wp-content\/uploads\/2024\/11\/frc-066b367482b31984e861abc85b43e23c.png\"><\/a><\/p>\n<p>\u56fe\u793a\uff1aDMS\u3001\u0394\u0394G \u548c \u0394Tm \u6570\u636e\u6c47\u603b\u3002\uff08\u6765\u6e90\uff1a\u8bba\u6587\uff09<\/p>\n<p>\u57fa\u4e8e\u6df1\u5ea6\u7a81\u53d8\u626b\u63cf (DMS) \u6570\u636e\u5e93\u53ef\u4ee5\u5f00\u53d1\u548c\u4f18\u5316\u86cb\u767d\u8d28\u9002\u5e94\u5ea6\u9884\u6d4b\u65b9\u6cd5\u3002\u7136\u800c\uff0cDMS \u6570\u636e\u7684\u591a\u6807\u7b7e\u7279\u6027\u963b\u788d\u4e86\u7edf\u4e00\u9884\u6d4b\u6a21\u578b\u7684\u8bad\u7ec3\u3002<\/p>\n<p>\u4e0e\u591a\u6807\u8bb0\u9002\u5e94\u5ea6\u6570\u636e\u4e0d\u540c\uff0c\u7a81\u53d8\u540e\u86cb\u767d\u8d28\u7a33\u5b9a\u6027\u7684\u53d8\u5316\u660e\u786e\u5730\u7531\u4e24\u4e2a\u6307\u6807 \u0394\u0394G \u548c \u0394Tm\u00a0\u5b9a\u4e49\uff0c\u5b9e\u9a8c\u6570\u636e\u7684\u79ef\u7d2f\u53ef\u4ee5\u5f00\u53d1\u76f8\u5e94\u7684\u9884\u6d4b\u7b97\u6cd5\u3002<\/p>\n<p>\u8fd1\u5e74\u6765\uff0c\u0394\u0394G \u7684\u9884\u6d4b\u53d7\u5230\u4e86\u6781\u5927\u7684\u5173\u6ce8\u3002\u76ee\u524d\u7684\u65b9\u6cd5\u4e3b\u8981\u53ef\u5206\u4e3a\u673a\u5236\u9884\u6d4b\u5668\u3001\u673a\u5668\u5b66\u4e60\u9884\u6d4b\u5668\u548c\u6df1\u5ea6\u5b66\u4e60\u9884\u6d4b\u5668\u3002\u4e0e \u0394\u0394G \u9884\u6d4b\u76f8\u6bd4\uff0c\u0394Tm\u00a0\u9884\u6d4b\u7684\u7814\u7a76\u76f8\u5bf9\u8f83\u5c11\u3002<\/p>\n<h1><span class=\"ez-toc-section\" id=\"%E5%9F%BA%E4%BA%8E%E5%87%A0%E4%BD%95%E5%AD%A6%E4%B9%A0%E7%9A%84%E4%B8%89%E4%B8%AA%E6%A8%A1%E5%9E%8B\"><\/span><strong>\u57fa\u4e8e\u51e0\u4f55\u5b66\u4e60\u7684\u4e09\u4e2a\u6a21\u578b<\/strong><span class=\"ez-toc-section-end\"><\/span><\/h1>\n<p>GeoStab \u5957\u4ef6\u5305\u542b\u4e09\u4e2a\u4e0d\u540c\u7684\u8f6f\u4ef6\u7a0b\u5e8f\uff1aGeoFitness\u3001GeoDDG \u548c GeoDTm\uff0c\u5b83\u4eec\u90fd\u5c06\u86cb\u767d\u8d28\u5e8f\u5217\u548c\u7ed3\u6784\u7684\u4fe1\u606f\u6c47\u603b\u5230\u57fa\u4e8e\u51e0\u4f55\u5b66\u4e60\u7684\u7f16\u7801\u5668\u4e2d\u8fdb\u884c\u9884\u6d4b\u3002<\/p>\n<p>\u51e0\u4f55\u7f16\u7801\u5668\u91c7\u7528\u56fe\u6ce8\u610f (GAT) \u795e\u7ecf\u7f51\u7edc\u67b6\u6784\uff0c\u5176\u4e2d\u8282\u70b9\uff08\u4e00\u7ef4\uff0c1D\uff09\u4ee3\u8868\u6c28\u57fa\u9178\u6b8b\u57fa\uff0c\u8fb9\u7f18\uff082D\uff09\u53cd\u6620\u6b8b\u57fa\u95f4\u7684\u76f8\u4e92\u4f5c\u7528\u3002<\/p>\n<p><a href=\"https:\/\/17aitech.com\/wp-content\/uploads\/2024\/11\/frc-b06ed6b9d816fa8fe5a0e667b9d741c3.png\" data-fancybox=\"images\" data-fancybox=\"gallery\"><img decoding=\"async\" src=\"https:\/\/17aitech.com\/wp-content\/uploads\/2024\/11\/frc-b06ed6b9d816fa8fe5a0e667b9d741c3.png\"><\/a><\/p>\n<section>\u56fe\u793a\uff1a\u6a21\u578b\u67b6\u6784\u793a\u610f\u56fe\u6982\u8ff0\u3002\uff08\u6765\u6e90\uff1a\u8bba\u6587\uff09<\/section>\n<p>GeoFitness \u662f\u4e00\u4e2a\u7edf\u4e00\u6a21\u578b\uff0c\u80fd\u591f\u9884\u6d4b\u6240\u6709\u5355\u4e2a\u7a81\u53d8\u7684\u86cb\u767d\u8d28\u53d8\u4f53\u7684\u9002\u5e94\u5ea6\u666f\u89c2\u3002\u5177\u4f53\u6765\u8bf4\uff0c\u7814\u7a76\u4eba\u5458\u8bbe\u8ba1\u4e86\u4e00\u4e2a\u7279\u6b8a\u7684\u635f\u5931\u51fd\u6570\uff0c\u5141\u8bb8\u4f7f\u7528 DMS 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