{"id":34220,"date":"2024-12-02T11:56:22","date_gmt":"2024-12-02T03:56:22","guid":{"rendered":"https:\/\/17aitech.com\/?p=34220"},"modified":"2024-12-02T11:56:22","modified_gmt":"2024-12-02T03:56:22","slug":"%e6%af%94%e4%bc%a0%e7%bb%9f%e6%96%b9%e6%b3%95%e9%ab%9830%e5%80%8d%ef%bc%8c%e4%b8%ad%e5%9b%bd%e7%a7%91%e5%ad%a6%e9%99%a2%e5%9b%a2%e9%98%9ftransformer%e6%b7%b1%e5%ba%a6%e5%ad%a6%e4%b9%a0%e6%a8%a1","status":"publish","type":"post","link":"https:\/\/17aitech.com\/?p=34220","title":{"rendered":"\u6bd4\u4f20\u7edf\u65b9\u6cd5\u9ad830\u500d\uff0c\u4e2d\u56fd\u79d1\u5b66\u9662\u56e2\u961fTransformer\u6df1\u5ea6\u5b66\u4e60\u6a21\u578b\u9884\u6d4b\u7cd6-\u86cb\u767d\u8d28\u4f5c\u7528\u4f4d\u70b9"},"content":{"rendered":"

\u6587\u7ae0\u6765\u6e90\u4e8e\u4e92\u8054\u7f51:\u6bd4\u4f20\u7edf\u65b9\u6cd5\u9ad830\u500d\uff0c\u4e2d\u56fd\u79d1\u5b66\u9662\u56e2\u961fTransformer\u6df1\u5ea6\u5b66\u4e60\u6a21\u578b\u9884\u6d4b\u7cd6-\u86cb\u767d\u8d28\u4f5c\u7528\u4f4d\u70b9<\/a><\/p>\n

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\u7f16\u8f91 | \u841d\u535c\u76ae<\/section>\n

\u7cd6\u7c7b\u662f\u81ea\u7136\u754c\u4e2d\u6700\u4e30\u5bcc\u7684\u6709\u673a\u7269\u8d28\uff0c\u5bf9\u751f\u547d\u81f3\u5173\u91cd\u8981\u3002\u4e86\u89e3\u7cd6\u7c7b\u5982\u4f55\u5728\u751f\u7406\u548c\u75c5\u7406\u8fc7\u7a0b\u4e2d\u8c03\u8282\u86cb\u767d\u8d28\uff0c\u53ef\u4ee5\u4e3a\u89e3\u51b3\u5173\u952e\u7684\u751f\u7269\u5b66\u95ee\u9898\u548c\u5f00\u53d1\u65b0\u7684\u6cbb\u7597\u65b9\u6cd5\u63d0\u4f9b\u673a\u9047\u3002<\/p>\n

\u7136\u800c\uff0c\u7cd6\u7c7b\u5206\u5b50\u7684\u591a\u6837\u6027\u548c\u590d\u6742\u6027\uff0c\u5bf9\u5b9e\u9a8c\u8bc6\u522b\u7cd6-\u86cb\u767d\u8d28\u7ed3\u5408\u4ee5\u53ca\u76f8\u4e92\u4f5c\u7528\u7684\u4f4d\u70b9\u63d0\u51fa\u4e86\u6311\u6218\u3002<\/p>\n

\u5728\u8fd9\u91cc\uff0c\u4e2d\u56fd\u79d1\u5b66\u9662\u56e2\u961f\u5f00\u53d1\u4e86\u4e00\u79cd\u6df1\u5ea6\u5b66\u4e60\u6a21\u578b DeepGlycanSite\uff0c\u5b83\u80fd\u591f\u51c6\u786e\u9884\u6d4b\u7ed9\u5b9a\u86cb\u767d\u8d28\u7ed3\u6784\u4e0a\u7684\u7cd6\u7ed3\u5408\u4f4d\u70b9\u3002<\/p>\n

DeepGlycanSite \u5c06\u86cb\u767d\u8d28\u7684\u51e0\u4f55\u548c\u8fdb\u5316\u7279\u5f81\u878d\u5165\u5177\u6709 Transformer \u67b6\u6784\u7684\u6df1\u5ea6\u7b49\u53d8\u56fe\u795e\u7ecf\u7f51\u7edc\u4e2d\uff0c\u5176\u6027\u80fd\u663e\u8457\u8d85\u8d8a\u4e86\u4e4b\u524d\u7684\u5148\u8fdb\u65b9\u6cd5\uff0c\u5e76\u80fd\u6709\u6548\u9884\u6d4b\u5404\u79cd\u7cd6\u7c7b\u5206\u5b50\u7684\u7ed3\u5408\u4f4d\u70b9\u3002<\/p>\n

\u7ed3\u5408\u8bf1\u53d8\u7814\u7a76\uff0cDeepGlycanSite \u63ed\u793a\u4e86\u91cd\u8981 G\u00a0\u86cb\u767d\u5076\u8054\u53d7\u4f53\u7684\u9e1f\u82f7-5′-\u4e8c\u78f7\u9178\u7cd6\u8bc6\u522b\u4f4d\u70b9\u3002<\/p>\n

\u8fd9\u4e9b\u53d1\u73b0\u8868\u660e DeepGlycanSite \u5bf9\u4e8e\u7cd6\u7ed3\u5408\u4f4d\u70b9\u9884\u6d4b\u5177\u6709\u91cd\u8981\u4ef7\u503c\uff0c\u5e76\u53ef\u4ee5\u6df1\u5165\u4e86\u89e3\u5177\u6709\u6cbb\u7597\u91cd\u8981\u6027\u86cb\u767d\u8d28\u7684\u7cd6\u7c7b\u8c03\u8282\u80cc\u540e\u7684\u5206\u5b50\u673a\u5236\u3002<\/p>\n

\u8be5\u7814\u7a76\u4ee5\u300cHighly accurate carbohydrate-binding site prediction with DeepGlycanSite<\/em>\u300d\u4e3a\u9898\uff0c\u4e8e 2024 \u5e74 6 \u6708 17 \u65e5\u53d1\u5e03\u5728\u300aNature Communications<\/em>\u300b\u3002<\/p>\n

<\/a><\/p>\n

\u7cd6\u5728\u6240\u6709\u751f\u7269\u4f53\u7684\u7ec6\u80de\u8868\u9762\u666e\u904d\u5b58\u5728\uff0c\u5b83\u4eec\u4e0e\u591a\u79cd\u86cb\u767d\u8d28\u5bb6\u65cf\u5982\u51dd\u96c6\u7d20\u3001\u6297\u4f53\u3001\u9176\u548c\u8f6c\u8fd0\u86cb\u767d\u76f8\u4e92\u4f5c\u7528\uff0c\u8c03\u8282\u514d\u75ab\u53cd\u5e94\u3001\u7ec6\u80de\u5206\u5316\u548c\u795e\u7ecf\u53d1\u80b2\u7b49\u5173\u952e\u751f\u7269\u5b66\u8fc7\u7a0b\u3002\u7406\u89e3\u7cd6\u7c7b\u4e0e\u86cb\u767d\u8d28\u7684\u76f8\u4e92\u4f5c\u7528\u673a\u5236\u662f\u5f00\u53d1\u7cd6\u7c7b\u836f\u7269\u7684\u57fa\u7840\u3002<\/p>\n

\u7136\u800c\uff0c\u7cd6\u7c7b\u7ed3\u6784\u7684\u591a\u6837\u6027\u548c\u590d\u6742\u6027\uff0c\u5c24\u5176\u662f\u5b83\u4eec\u4e0e\u86cb\u767d\u8d28\u7ed3\u5408\u4f4d\u70b9\u7684\u591a\u53d8\u6027\uff0c\u7ed9\u5b9e\u9a8c\u6570\u636e\u7684\u83b7\u53d6\u548c\u836f\u7269\u8bbe\u8ba1\u5e26\u6765\u4e86\u6311\u6218\u3002<\/p>\n

<\/a><\/p>\n

\u56fe\u793a\uff1a\u7cd6\u7c7b\u5206\u5b50\u7684\u590d\u6742\u6027\u548c\u7cd6\u7ed3\u5408\u4f4d\u70b9\u7684\u591a\u6837\u6027\u3002\uff08\u6765\u6e90\uff1a\u8bba\u6587\uff09<\/p>\n

\u8fc7\u53bb\uff0c\u4f20\u7edf\u7684\u7ed3\u5408\u4f4d\u70b9\u9884\u6d4b\u65b9\u6cd5\u4e0d\u9002\u7528\u4e8e\u7ed3\u6784\u590d\u6742\u3001\u5927\u5c0f\u53d8\u5316\u5927\u7684\u7cd6\u7c7b\u5206\u5b50\u3002\u52a0\u4e4b\u9ad8\u5206\u8fa8\u7387\u7cd6-\u86cb\u767d\u8d28\u590d\u5408\u7269\u7ed3\u6784\u6570\u636e\u7684\u7a00\u7f3a\uff0c\u5bfc\u81f4\u9884\u6d4b\u6a21\u578b\u7684\u6027\u80fd\u53d7\u9650\u3002<\/p>\n

\u8fd1\u5e74\u6765\uff0c\u968f\u7740\u86cb\u767d\u8d28\u6570\u636e\u5e93\uff08PDB\uff09\u548c\u5f00\u653e\u7cd6\u7ec4\u5b66\u8d44\u6e90\u7684\u5feb\u901f\u53d1\u5c55\uff0c\u5b66\u754c\u5df2\u7ecf\u79ef\u7d2f\u4e86\u8d85\u8fc7 19000 \u4e2a\u6b64\u7c7b\u590d\u5408\u7269\u7684\u7ed3\u6784\u6570\u636e\u3002\u8fd9\u4e9b\u9ad8\u8d28\u91cf\u6570\u636e\u7684\u589e\u52a0\uff0c\u4e3a\u91c7\u7528 AI \u6280\u672f\u5f00\u53d1\u7cbe\u786e\u7684\u7cd6\u7ed3\u5408\u4f4d\u70b9\u9884\u6d4b\u6a21\u578b\u63d0\u4f9b\u4e86\u53ef\u80fd\uff0c\u4ece\u800c\u6709\u671b\u52a0\u901f\u7cd6\u7c7b\u836f\u7269\u7684\u53d1\u73b0\u548c\u4f18\u5316\u8fc7\u7a0b\u3002<\/p>\n

\u5728\u6700\u65b0\u7684\u7814\u7a76\u4e2d\uff0c\u4e2d\u56fd\u79d1\u5b66\u9662\u56e2\u961f\u5f15\u5165\u4e86 DeepGlycanSite\uff0c\u8fd9\u662f\u4e00\u79cd\u6df1\u5ea6\u7b49\u53d8\u56fe\u795e\u7ecf\u7f51\u7edc (EGNN) \u6a21\u578b\uff0c\u80fd\u591f\u51c6\u786e\u9884\u6d4b\u5177\u6709\u76ee\u6807\u86cb\u767d\u8d28\u7ed3\u6784\u7684\u7cd6\u7ed3\u5408\u4f4d\u70b9\u3002<\/p>\n

<\/a><\/p>\n

\u56fe\u793a\uff1aDeepGlycanSite \u6982\u8ff0\u3002\uff08\u6765\u6e90\uff1a\u8bba\u6587\uff09<\/p>\n

\u8be5\u56e2\u961f\u5229\u7528\u51e0\u4f55\u7279\u5f81\uff08\u4f8b\u5982\u6b8b\u57fa\u5185\u548c\u6b8b\u57fa\u95f4\u7684\u65b9\u5411\u548c\u8ddd\u79bb\uff09\u4ee5\u53ca\u8fdb\u5316\u4fe1\u606f\uff0c\u5728 DeepGlycanSite \u4e2d\u4ee5\u6b8b\u57fa\u7ea7\u522b\u7684\u56fe\u5f62\u8868\u793a\u5f62\u5f0f\u5448\u73b0\u86cb\u767d\u8d28\u3002\u7ed3\u5408\u5177\u6709\u81ea\u6ce8\u610f\u529b\u673a\u5236\u7684 Transformer \u5757\u6765\u589e\u5f3a\u7279\u5f81\u63d0\u53d6\u548c\u590d\u6742\u5173\u7cfb\u53d1\u73b0\u3002<\/p>\n

\u5728\u6d89\u53ca\u4e00\u767e\u591a\u79cd\u72ec\u7279\u7cd6\u7ed3\u5408\u86cb\u767d\u7684\u72ec\u7acb\u6d4b\u8bd5\u96c6\u4e0a\uff0c\u7814\u7a76\u4eba\u5458\u5c06 DeepGlycanSite \u4e0e\u5f53\u524d\u6700\u5148\u8fdb\u7684\u8ba1\u7b97\u65b9\u6cd5\u8fdb\u884c\u4e86\u6bd4\u8f83\u3002<\/p>\n

\u7ed3\u679c\u663e\u793a\uff0cDeepGlycanSite \uff080.625\uff09 \u7684\u5e73\u5747\u9a6c\u4fee\u65af\u76f8\u5173\u7cfb\u6570\uff08MCC\uff09 \u662f StackCBPred \uff080.018\uff09 \u7684 30 \u500d\u4ee5\u4e0a\uff0c\u540c\u65f6\u8fdc\u8d85\u5176\u4ed6\u5e8f\u5217\u57fa\u7840\u7684\u9884\u6d4b\u65b9\u6cd5\u3002<\/p>\n

\u4f20\u7edf\u914d\u4f53\u7ed3\u5408\u4f4d\u70b9\u65b9\u6cd5\u53ef\u80fd\u56e0\u758f\u6c34\u6027\u6216\u5c0f\u5c3a\u5bf8\u800c\u6392\u9664\u7b80\u5355\u7cd6\u7c7b\u5206\u5b50\u7684\u7ed3\u5408\u4f4d\u70b9\uff0c\u800c DeepGlycanSite \u5219\u80fd\u6709\u6548\u8bc6\u522b\u8fd9\u4e9b\u4f4d\u70b9\u3002<\/p>\n

<\/a><\/p>\n

\u56fe\u793a\uff1a\u6bd4\u8f83\u6a21\u578b\u5728\u9884\u6d4b\u4e0d\u540c\u7cd6\u7ed3\u5408\u4f4d\u70b9\u65b9\u9762\u7684\u8868\u73b0\u3002\uff08\u6765\u6e90\uff1a\u8bba\u6587\uff09<\/p>\n

\u5e76\u4e14\uff0cDeepGlycanSite \u5728\u9884\u6d4b\u86cb\u767d\u8d28\u4e0a\u7684\u591a\u4e2a\u7cd6\u7ed3\u5408\u4f4d\u70b9\u65b9\u9762\u4e5f\u8868\u73b0\u51fa\u8272\uff0c\u8fd9\u5bf9\u4e8e\u7406\u89e3\u591a\u4ef7\u7cd6\u7f00\u5408\u7269\u5982\u4f55\u5f71\u54cd\u7cd6-\u86cb\u767d\u76f8\u4e92\u4f5c\u7528\u4ee5\u53ca\u751f\u7269\u8fc7\u7a0b\u7684\u8c03\u63a7\u5177\u6709\u91cd\u8981\u4ef7\u503c\u3002\u4f8b\u5982\uff0c\u591a\u4ef7\u7cd6\u7f00\u5408\u7269\u88ab\u8bbe\u8ba1\u6210\u5316\u5b66\u5de5\u5177\u548c\u836f\u7269\u5019\u9009\u7269\uff0c\u4ee5\u5f71\u54cd\u7cd6\u7c7b\u5206\u5b50\u4e0e\u51dd\u96c6\u7d20\u4e4b\u95f4\u7684\u76f8\u4e92\u4f5c\u7528\u3002<\/p>\n

\u4e0e\u4f20\u7edf\u7684\u4ec5\u4f7f\u7528\u86cb\u767d\u8d28\u5e8f\u5217\u6216\u7ed3\u6784\u4fe1\u606f\u7684\u65b9\u6cd5\u4e0d\u540c\uff0cDeepGlycanSite \u5145\u5206\u8003\u8651\u4e86\u86cb\u767d\u8d28\u7684\u51e0\u4f55\u4fe1\u606f\u53ca\u8fdb\u5316\u7279\u6027\uff0c\u8fd9\u53ef\u80fd\u662f\u5176\u8868\u73b0\u4f18\u5f02\u7684\u5173\u952e\u56e0\u7d20\u3002<\/p>\n

\u6b64\u5916\uff0c\u7ed9\u5b9a\u67e5\u8be2\u7cd6\u7c7b\u5206\u5b50\u7684\u5316\u5b66\u7ed3\u6784\uff0cDeepGlycanSite \u8fd8\u53ef\u4ee5\u9884\u6d4b\u5176\u7279\u5b9a\u7ed3\u5408\u4f4d\u70b9\u3002<\/p>\n

<\/a><\/p>\n

\u56fe\u793a\uff1a\u67e5\u8be2\u7cd6\u7684\u7279\u5b9a\u7ed3\u5408\u4f4d\u70b9\u9884\u6d4b\u3002\uff08\u6765\u6e90\uff1a\u8bba\u6587\uff09<\/p>\n

\u7814\u7a76\u4eba\u5458\u63a2\u7d22\u4e86 DeepGlycanSite \u5bf9\u529f\u80fd\u91cd\u8981\u7684 G \u86cb\u767d\u5076\u8054\u53d7\u4f53 (GPCR) \u7684\u5e94\u7528\u3002\u5229\u7528 AlphaFold2 \u9884\u6d4b\u7684\u86cb\u767d\u8d28\u7ed3\u6784\u548c\u7cd6\u7c7b\u5316\u5b66\u7ed3\u6784\uff0cDeepGlycanSite \u6210\u529f\u68c0\u6d4b\u5230\u4e86\u4eba\u7c7b P2Y14 \u4e0a GDP-Fuc \u7684\u5177\u4f53\u7ed3\u5408\u4f4d\u70b9\u3002<\/p>\n

<\/a><\/p>\n

\u56fe\u793a\uff1aDeepGlycanSite \u7684\u5b9e\u9a8c\u9a8c\u8bc1\u3002\uff08\u6765\u6e90\uff1a\u8bba\u6587\uff09<\/section>\n

\u867d\u7136 AlphaFold2 \u9884\u6d4b\u7684\u4fa7\u94fe\u8d28\u91cf\u6709\u5f85\u63d0\u9ad8\uff0c\u4f46 DeepGlycanSite \u5bf9\u86cb\u767d\u8d28\u7ed3\u6784\u51c6\u786e\u6027\u7684\u4f9d\u8d56\u8f83\u4f4e\uff0c\u80fd\u591f\u4f7f\u7528\u9884\u6d4b\u7684\u86cb\u767d\u8d28\u7ed3\u6784\u63d0\u4f9b\u7cd6-\u86cb\u767d\u76f8\u4e92\u4f5c\u7528\u7684\u89c1\u89e3\u3002<\/p>\n

\u7efc\u4e0a\u6240\u8ff0\uff0cDeepGlycanSite \u5728\u72ec\u7acb\u6d4b\u8bd5\u96c6\u548c\u4f53\u5916\u6848\u4f8b\u7814\u7a76\u4e2d\u7684\u9a8c\u8bc1\u8868\u660e\uff0c\u5b83\u662f\u4e00\u4e2a\u6709\u6548\u7684\u7cd6\u7ed3\u5408\u4f4d\u70b9\u9884\u6d4b\u5de5\u5177\u3002\u7814\u7a76\u4eba\u5458\u53ef\u4ee5\u5229\u7528 DeepGlycanSite \u9884\u6d4b\u76ee\u6807\u86cb\u767d\u8d28\u4e0a\u7684\u7cd6\u7ed3\u5408\u53e3\u888b\uff0c\u4ece\u800c\u4fc3\u8fdb\u5bf9\u7cd6-\u86cb\u767d\u8d28\u76f8\u4e92\u4f5c\u7528\u7684\u7406\u89e3\u3002<\/p>\n

\u7cd6\u7c7b\u5728\u751f\u7269\u5b66\u529f\u80fd\u4e2d\u626e\u6f14\u7740\u5173\u952e\u89d2\u8272\uff0cDeepGlycanSite \u4e0d\u4ec5\u6709\u52a9\u4e8e\u89e3\u6790\u7cd6\u7c7b\u5206\u5b50\u548c\u7cd6\u7ed3\u5408\u86cb\u767d\u7684\u751f\u7269\u5b66\u529f\u80fd\uff0c\u4e5f\u4e3a\u7cd6\u7c7b\u836f\u7269\u7684\u5f00\u53d1\u63d0\u4f9b\u4e86\u6709\u529b\u5de5\u5177\u3002<\/p>\n

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