{"id":1104942,"date":"2024-11-15T19:03:20","date_gmt":"2024-11-16T03:03:20","guid":{"rendered":"https:\/\/www.microsoft.com\/en-us\/research\/?post_type=msr-blog-post&#038;p=1104942"},"modified":"2024-11-17T19:05:08","modified_gmt":"2024-11-18T03:05:08","slug":"dialogue-with-ai2bmd-team","status":"publish","type":"msr-blog-post","link":"https:\/\/www.microsoft.com\/en-us\/research\/articles\/dialogue-with-ai2bmd-team\/","title":{"rendered":"\u5bf9\u8bdd\u300aNature\u300b\u8bba\u6587\u4f5c\u8005\uff0c\u63ed\u79d8AI2BMD\u80cc\u540e\u7684\u6545\u4e8b"},"content":{"rendered":"\n<p><em>\u4f5c\u8005\uff1a\u79d1\u5b66\u667a\u80fd\u4e2d\u5fc3<\/em><\/p>\n\n\n\n<p>\u7f16\u8005\u6309\uff1a\u8fd1\u671f\uff0c\u79d1\u5b66\u6742\u5fd7\u300a\u81ea\u7136\u300b\uff08\u300aNature\u300b\uff09\u6b63\u520a\u53d1\u8868\u4e86\u5fae\u8f6f\u7814\u7a76\u9662\u79d1\u5b66\u667a\u80fd\u4e2d\u5fc3\uff08AI for Science\uff09\u56e2\u961f\u7684\u7814\u53d1\u6210\u679c\u2014\u2014<a href=\"https:\/\/www.microsoft.com\/en-us\/research\/articles\/ai2bmd-nature\/\">\u9996\u4e2a\u57fa\u4e8e\u4eba\u5de5\u667a\u80fd\u7684\u751f\u7269\u5206\u5b50\u91cf\u5b50\u7ea7\u7cbe\u5ea6\u52a8\u529b\u5b66\u6a21\u62df\u7cfb\u7edf AI<sup>2<\/sup>BMD<\/a>\u3002\u8be5\u7cfb\u7edf\u4e0d\u4ec5\u7a81\u7834\u4e86\u4f20\u7edf\u751f\u7269\u52a8\u6001\u7814\u7a76\u65b9\u6cd5\u7684\u74f6\u9888\uff0c\u540c\u65f6\u4e5f\u6781\u5927\u5730\u4fc3\u8fdb\u4e86\u4eba\u5de5\u667a\u80fd\u5728\u751f\u7269\u5206\u5b50\u6a21\u62df\u9886\u57df\u7684\u5e94\u7528\uff0c\u63a8\u52a8\u4e86\u836f\u7269\u8bbe\u8ba1\u3001\u9176\u5de5\u7a0b\u548c\u75ab\u82d7\u7814\u53d1\u7b49\u9886\u57df\u7684\u521b\u65b0\u8fdb\u5c55\u3002<\/p>\n\n\n\n<p>AI<sup>2<\/sup>BMD \u7814\u7a76\u8fc7\u7a0b\u4e2d\u9762\u4e34\u4e86\u54ea\u4e9b\u6311\u6218\uff1f\u7814\u7a76\u56e2\u961f\u53c8\u662f\u5982\u4f55\u5728\u56db\u5e74\u5185\u653b\u514b\u751f\u7269\u5206\u5b50\u6a21\u62df\u9886\u57df\u7684\u957f\u671f\u96be\u9898\u7684\uff1f\u6765\u81ea AI<sup>2<\/sup>BMD \u7814\u7a76\u56e2\u961f\u7684\u5fae\u8f6f\u7814\u7a76\u9662\u9ad8\u7ea7\u7814\u7a76\u5458\u738b\u7ae5\u3001\u9996\u5e2d\u7814\u7a76\u5458\u5218\u6d77\u5e7f\u3001\u9ad8\u7ea7\u5de5\u7a0b\u5e08\u6bd5\u7136\u5411\u5927\u5bb6\u5206\u4eab\u4e86\u7814\u7a76\u80cc\u540e\u7684\u6545\u4e8b\u3002<\/p>\n\n\n\n<hr class=\"wp-block-separator has-alpha-channel-opacity\"\/>\n\n\n\n<figure class=\"wp-block-image size-large\"><img loading=\"lazy\" decoding=\"async\" width=\"1024\" height=\"735\" src=\"https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-1-1024x735.png\" alt=\"diagram\" class=\"wp-image-1104957\" srcset=\"https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-1-1024x735.png 1024w, https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-1-300x215.png 300w, https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-1-768x551.png 768w, https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-1-1536x1103.png 1536w, https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-1-2048x1470.png 2048w, https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-1-240x172.png 240w\" sizes=\"auto, (max-width: 1024px) 100vw, 1024px\" 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\u6a21\u62df\u7cfb\u7edf\u3002\u6211\u4eec\u6bcf\u5929\u90fd\u5728\u9762\u4e34\u5404\u79cd\u5168\u65b0\u7684\u6311\u6218\u3002<\/p>\n\n\n\n<p>\u4e0e\u5176\u4ed6\u63a2\u7d22\u8fd9\u4e2a\u9886\u57df\u7684\u5de5\u4f5c\u76f8\u6bd4\uff0cAI<sup>2<\/sup>BMD \u7684\u7279\u70b9\u5728\u4e8e\u5b83\u65e0\u9700\u4e3a\u6bcf\u79cd\u65b0\u86cb\u767d\u8d28\u751f\u6210\u65b0\u7684\u6570\u636e\u5e76\u8bad\u7ec3\u6df1\u5ea6\u5b66\u4e60\u6a21\u578b\uff0c\u6240\u4ee5 AI<sup>2<\/sup>BMD 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href=\"https:\/\/www.microsoft.com\/en-us\/research\/articles\/visnet\/\">\u53ef\u7528\u4e8e\u5206\u5b50\u51e0\u4f55\u5efa\u6a21\u7684\u56fe\u795e\u7ecf\u7f51\u7edc ViSNet<\/a>\uff0c\u4ee5\u6b64\u6765\u4f5c\u4e3a AI<sup>2<\/sup>BMD \u7684\u673a\u5668\u5b66\u4e60\u529b\u573a\u3002\u6b64\u5916\uff0c\u901a\u8fc7\u540c\u65f6\u9ad8\u6548\u5229\u7528 CPU \u548c GPU\uff0c\u6211\u4eec\u8fd8\u8bbe\u8ba1\u4e86 AI<sup>2<\/sup>BMD \u7684\u6a21\u62df\u7cfb\u7edf\uff0c\u5b9e\u73b0\u4e86\u6bd4\u4e00\u5e74\u524d\u63d0\u901f\u767e\u500d\u7684\u6a21\u62df\u901f\u5ea6\uff0c\u5e76\u5c06 AI \u9a71\u52a8\u7684\u6a21\u62df\u52a0\u901f\u81f3\u6bcf\u6b65\u4ec5\u9700\u5341\u5230\u4e00\u767e\u6beb\u79d2\u3002<\/p>\n\n\n\n<p>\u6700\u7ec8\u6211\u4eec\u5c06 AI<sup>2<\/sup>BMD \u5728\u80fd\u91cf\u3001\u529b\u3001\u81ea\u7531\u80fd\u3001J-\u8026\u5408\u548c\u591a\u79cd\u6027\u8d28\u8ba1\u7b97\u4e2d\uff0c\u5bf9\u6570\u5341\u79cd\u86cb\u767d\u8d28\u8fdb\u884c\u4e86\u9a8c\u8bc1\uff0c<a href=\"https:\/\/www.microsoft.com\/en-us\/research\/articles\/ai-drug-rd-algorithm-competition\/\">\u5e76\u5728\u836f\u7269\u5f00\u53d1\u7ade\u8d5b\u4e2d\u5e94\u7528\u4e86 AI<sup>2<\/sup>BMD\uff0c\u5747\u83b7\u5f97\u4e86\u7406\u60f3\u7684\u7ed3\u679c<\/a>\u3002<\/p>\n\n\n\n<p><strong>Q\uff1a\u8fdb\u884c\u8fd9\u9879\u7814\u7a76\u7684\u65b9\u6cd5\u8bba\u662f\u4ec0\u4e48\uff1f<\/strong><\/p>\n\n\n\n<p><strong>\u738b\u7ae5\uff1a<\/strong>\u4e0d\u540c\u4e13\u4e1a\u77e5\u8bc6\u7684\u878d\u5408\u534f\u4f5c\u662f AI<sup>2<\/sup>BMD \u7814\u7a76\u6210\u529f\u7684\u5173\u952e\u3002\u6211\u4eec\u7684\u56e2\u961f\u7531\u5177\u6709\u751f\u7269\u5b66\u3001\u5316\u5b66\u3001\u7269\u7406\u5b66\u3001\u6570\u5b66\u3001\u8ba1\u7b97\u673a\u79d1\u5b66\u548c\u5de5\u7a0b\u5b66\u80cc\u666f\u7684\u79d1\u7814\u4eba\u5458\u7ec4\u6210\u3002\u6b64\u5916\uff0c\u6211\u4eec\u8fd8\u4e0e\u8bb8\u591a\u5206\u5b50\u52a8\u529b\u5b66\u6a21\u62df\u9886\u57df\u7684\u8d44\u6df1\u4e13\u5bb6\u8fdb\u884c\u4e86\u4ea4\u6d41\u4e0e\u5408\u4f5c\uff0c\u4ed6\u4eec\u63d0\u4f9b\u4e86\u5f88\u591a\u975e\u5e38\u6709\u5efa\u8bbe\u6027\u7684\u5efa\u8bae\u3002<\/p>\n\n\n\n<p>\u53e6\u5916\u4e00\u4e2a\u6211\u60f3\u5f3a\u8c03\u7684\u5173\u952e\u662f\uff0c\u8981\u4ece\u975e\u9884\u671f\u7684\u7ed3\u679c\u4e2d\u4e0d\u65ad\u5b66\u4e60\u3002\u5728\u79d1\u5b66\u7814\u7a76\u7684\u8fc7\u7a0b\u4e2d\uff0c\u5931\u8d25\u662f\u4e0d\u53ef\u907f\u514d\u7684\u3002\u5bf9\u6b64\u6211\u4eec\u8981\u505a\u7684\u662f\u79ef\u6781\u9762\u5bf9\uff0c\u4e0d\u65ad\u5206\u6790\u5931\u8d25\u539f\u56e0\uff0c\u5e76\u76f8\u5e94\u5730\u8c03\u6574\u6211\u4eec\u7684\u7b97\u6cd5\u548c\u6a21\u578b\u3002\u5bf9\u4e8e\u4e00\u4e2a\u7814\u7a76\u8bfe\u9898\u6765\u8bf4\uff0c\u6ca1\u6709\u5b8c\u7f8e\u7684\u89e3\u51b3\u65b9\u6848\uff0c\u6211\u4eec\u603b\u662f\u5728\u8def\u4e0a\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image size-full\"><img loading=\"lazy\" decoding=\"async\" width=\"800\" height=\"532\" src=\"https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-2.jpg\" alt=\"\u5fae\u8f6f\u7814\u7a76\u9662\u9996\u5e2d\u7814\u7a76\u5458\u5218\u6d77\u5e7f\uff08\u53f3\u4e00\uff09\u3001\u9ad8\u7ea7\u5de5\u7a0b\u5e08\u6bd5\u7136\uff08\u4e2d\uff09\u3001\u9ad8\u7ea7\u7814\u7a76\u5458\u738b\u7ae5\uff08\u5de6\u4e00\uff09\" class=\"wp-image-1104954\" srcset=\"https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-2.jpg 800w, https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-2-300x200.jpg 300w, https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-2-768x511.jpg 768w, https:\/\/www.microsoft.com\/en-us\/research\/wp-content\/uploads\/2024\/11\/dialogue-with-ai2bmd-team-2-240x160.jpg 240w\" sizes=\"auto, (max-width: 800px) 100vw, 800px\" \/><figcaption class=\"wp-element-caption\">\u5fae\u8f6f\u7814\u7a76\u9662\u9996\u5e2d\u7814\u7a76\u5458\u5218\u6d77\u5e7f\uff08\u53f3\u4e00\uff09\u3001\u9ad8\u7ea7\u5de5\u7a0b\u5e08\u6bd5\u7136\uff08\u4e2d\uff09\u3001\u9ad8\u7ea7\u7814\u7a76\u5458\u738b\u7ae5\uff08\u5de6\u4e00\uff09<\/figcaption><\/figure>\n\n\n\n<p><strong>Q\uff1a\u4ece\u53bb\u5e74\u7684\u9884\u5370\u672c\u5230\u4eca\u5e74\u53d1\u8868\u5728\u300a\u81ea\u7136\u300b\u6742\u5fd7\u4e0a\uff0c\u6211\u4eec\u770b\u5230 AI<sup>2<\/sup>BMD \u7684\u6280\u672f\u8bbe\u8ba1\u548c\u5b9e\u9a8c\u7ed3\u679c\u6709\u4e86\u5f88\u591a\u7684\u5347\u7ea7\uff0c\u8bf7\u5927\u6982\u4ecb\u7ecd\u4e00\u4e0b\u6700\u65b0\u7248\u7684\u529f\u80fd\u7279\u70b9\u4ee5\u53ca\u521b\u65b0\u4e4b\u5904\u3002<\/strong><\/p>\n\n\n\n<p><strong>\u738b\u7ae5\uff1a<\/strong>2023\u5e74\u590f\u5929\u6211\u4eec\u5728\u9884\u5370\u672c\u5e73\u53f0 bioRxiv \u4e0a\u53d1\u5e03\u4e86 AI<sup>2<\/sup>BMD \u624b\u7a3f\u7684\u521d\u6b65\u7248\u672c\u3002\u5728\u8fd1\u4e00\u5e74\u534a\u7684\u65f6\u95f4\u4e2d AI<sup>2<\/sup>BMD \u53d6\u5f97\u4e86\u4e24\u4e2a\u91cd\u8981\u7684\u5347\u7ea7\u3002\u7b2c\u4e00\u4e2a\u662f AI<sup>2<\/sup>BMD \u7684\u6a21\u62df\u901f\u5ea6\u63d0\u5347\u4e86\u6570\u767e\u500d\uff0c\u6210\u4e3a\u76ee\u524d\u6700\u5feb\u7684 AI \u9a71\u52a8\u5206\u5b50\u52a8\u529b\u5b66\u6a21\u62df\u7cfb\u7edf\u4e4b\u4e00\uff0c\u5e76\u80fd\u591f\u8fdb\u884c\u6bd4\u4ee5\u524d\u66f4\u957f\u65f6\u95f4\u7684\u6a21\u62df\u3002\u7b2c\u4e8c\u4e2a\u662f AI<sup>2<\/sup>BMD \u88ab\u5e94\u7528\u4e8e\u8bb8\u591a\u86cb\u767d\u8d28\u6027\u8d28\u7684\u8ba1\u7b97\uff0c\u5982\u7113\u3001\u70ed\u5bb9\u91cf\u3001\u6298\u53e0\u81ea\u7531\u80fd\u3001pKa \u7b49\u6307\u6807\u4e0a\u3002<\/p>\n\n\n\n<p><strong>Q\uff1aAI<sup>2<\/sup>BMD \u662f\u5982\u4f55\u5b9e\u73b0\u5982\u6b64\u663e\u8457\u7684\u52a0\u901f\u6548\u679c\u7684\uff1f\u5728\u7cfb\u7edf\u8bbe\u8ba1\u4e0a\u6709\u54ea\u4e9b\u72ec\u7279\u4e4b\u5904\uff1f<\/strong><\/p>\n\n\n\n<p><strong>\u6bd5\u7136\uff1a<\/strong>AI<sup>2<\/sup>BMD \u7684\u6a21\u62df\u7cfb\u7edf\u6709\u591a\u4e2a\u6a21\u5757\u3002\u9664\u4e86\u4f18\u5316\u4ee3\u7801\u6765\u63d0\u5347\u5404\u4e2a\u6a21\u5757\u7684\u8fd0\u7b97\u901f\u5ea6\uff0c\u6211\u4eec\u8fd8\u9700\u8981\u8003\u8651\u5982\u4f55\u5728\u6ee1\u8db3\u5404\u4e2a\u6a21\u5757\u4f9d\u8d56\u5173\u7cfb\u7684\u524d\u63d0\u4e0b\uff0c\u628a\u6709\u9650\u7684\u8ba1\u7b97\u8d44\u6e90\u5408\u7406\u5206\u914d\u7ed9\u5404\u4e2a\u6a21\u5757\uff0c\u4ece\u800c\u4f7f\u5f97\u6574\u4f53\u6a21\u62df\u901f\u5ea6\u5728\u4e0d\u540c\u86cb\u767d\u5927\u5c0f\u3001\u8ba1\u7b97\u5355\u5143\u914d\u6bd4\u4e0b\u90fd\u80fd\u591f\u518d\u6b21\u5f97\u5230\u63d0\u5347\u3002<\/p>\n\n\n\n<p><strong>Q\uff1a\u4f5c\u4e3a\u4e00\u4e2a\u57fa\u4e8e\u4eba\u5de5\u667a\u80fd\u7684\u751f\u7269\u5206\u5b50\u91cf\u5b50\u7ea7\u7cbe\u5ea6\u52a8\u529b\u5b66\u6a21\u62df\u7cfb\u7edf\uff0cAI<sup>2<\/sup>BMD \u5bf9\u751f\u7269\u5b66\u548c AI \u7814\u7a76\u6709\u4f55\u610f\u4e49\uff1f\u5b83\u53c8\u5c06\u5bf9\u73b0\u5b9e\u4e16\u754c\u5e26\u6765\u54ea\u4e9b\u5f71\u54cd\uff1f<\/strong><\/p>\n\n\n\n<p><strong>\u738b\u7ae5\uff1a<\/strong>\u5bf9\u4e8e\u751f\u7269\u5b66\uff0cAI<sup>2<\/sup>BMD \u63d0\u4f9b\u4e86\u4e00\u79cd\u6bd4\u8fc7\u53bb\u51e0\u5341\u5e74\u4f7f\u7528\u7684\u65b9\u6cd5\u90fd\u66f4\u52a0\u51c6\u786e\u7684\u65b9\u6cd5\uff0c\u6765\u6a21\u62df\u86cb\u767d\u8d28\u52a8\u6001\u8fd0\u52a8\uff0c\u5e76\u7814\u7a76\u751f\u7269\u6d3b\u6027\u3002\u5bf9\u4e8e\u4eba\u5de5\u667a\u80fd\uff0cAI<sup>2<\/sup>BMD \u8bc1\u660e\u4e86 AI \u53ef\u4ee5\u5728\u52a8\u6001\u86cb\u767d\u8d28\u7ed3\u6784\u7814\u7a76\u4e2d\u53d1\u6325\u91cd\u5927\u4f5c\u7528\uff0c\u8fd9\u751a\u81f3\u8d85\u8d8a\u4e86 AI \u5728\u86cb\u767d\u8d28\u9759\u6001\u7ed3\u6784\u9884\u6d4b\u4e2d\u7684\u5e94\u7528\u3002<\/p>\n\n\n\n<p>\u8fd9\u5c06\u4e3a\u836f\u7269\u548c\u9776\u86cb\u767d\u590d\u5408\u7269\u63d0\u4f9b\u5177\u6709\u91cf\u5b50\u7ea7\u6a21\u62df\u7cbe\u5ea6\u7684\u7ed3\u5408\u81ea\u7531\u80fd\u8ba1\u7b97\uff0c\u68c0\u6d4b\u7ecf\u5178\u529b\u5b66\u6a21\u62df\u65e0\u6cd5\u8fbe\u5230\u7684\u66f4\u7075\u6d3b\u7684\u751f\u7269\u5206\u5b50\u6784\u8c61\u53d8\u5316\uff0c\u5e76\u4e3a\u9176\u5de5\u7a0b\u3001\u75ab\u82d7\u548c\u6297\u4f53\u8bbe\u8ba1\u521b\u9020\u66f4\u591a\u673a\u4f1a\u3002<\/p>\n\n\n\n<p><strong>Q\uff1a\u4e0e GHDDI \u7684\u5408\u4f5c\u53ef\u4ee5\u8bf4\u662f\u5728\u5b9e\u9645\u5e94\u7528\u4e2d\u7684\u4e00\u79cd\u5c1d\u8bd5\uff0c\u90a3\u4e48\u53cc\u65b9\u7684\u5951\u673a\u4ee5\u53ca\u5408\u4f5c\u613f\u666f\u662f\u4ec0\u4e48\uff1f<\/strong><\/p>\n\n\n\n<p><strong>\u5218\u6d77\u5e7f\uff1a<\/strong>\u836f\u7269\u901a\u5e38\u4f5c\u7528\u5728\u751f\u7269\u5927\u5206\u5b50\u4e0a\uff0c\u4e5f\u5c31\u662f\u5e38\u8bf4\u7684\u9776\u70b9\u3002\u86cb\u767d\u8d28\u5206\u5b50\u662f\u76ee\u524d\u6700\u91cd\u8981\u7684\u836f\u7269\u9776\u70b9\uff0cAI<sup>2<\/sup>BMD \u5bf9\u6b64\u6709\u4e24\u4e2a\u65b9\u9762\u7684\u4e3b\u8981\u5e94\u7528\uff1a\u4e00\u4e2a\u662f\uff0c\u5bf9\u86cb\u767d\u8d28\u7684\u7ed3\u6784\u6709\u52a8\u6001\u63cf\u8ff0\uff0c\u5c24\u5176\u662f\u53d1\u73b0\u66f4\u591a\u6709\u4ef7\u503c\u7684\u7ed3\u6784\uff0c\u4ece\u800c\u53ef\u4ee5\u66f4\u5168\u9762\u5730\u8ba4\u8bc6\u9776\u70b9\uff1b\u53e6\u5916\u4e00\u4e2a\u5c31\u662f\u66f4\u52a0\u51c6\u786e\u5730\u8ba1\u7b97\u9776\u70b9\u86cb\u767d\u4e0e\u836f\u7269\u5206\u5b50\uff08\u6216\u8005\u5907\u9009\u5206\u5b50\uff09\u7684\u7269\u7406\u5316\u5b66\u76f8\u4e92\u4f5c\u7528\u3002\u5728\u4e0e GHDDI \u7684\u4ea4\u6d41\u8fc7\u7a0b\u4e2d\uff0c\u5927\u5bb6\u90fd\u5bf9\u8fd9\u4e2a\u65b9\u6cd5\u5bc4\u4e88\u539a\u671b\u3002\u6211\u4eec\u5e0c\u671b\u80fd\u591f\u901a\u8fc7\u8ba1\u7b97\u7684\u65b9\u6cd5\u5bf9\u9776\u70b9\u4e0e\u836f\u7269\u5206\u5b50\u7684\u76f8\u4e92\u4f5c\u7528\u83b7\u5f97\u66f4\u51c6\u786e\u7684\u5b9a\u91cf\u4fe1\u606f\uff0c\u4ece\u800c\u52a0\u901f\u836f\u7269\u7814\u53d1\u3002<\/p>\n\n\n\n<p><strong>Q\uff1a\u5728\u6574\u4e2a\u7814\u7a76\u8fc7\u7a0b\u4e2d\uff0c\u5927\u5bb6\u6709\u54ea\u4e9b\u611f\u609f\uff1f\u5bf9\u4e8e AI for Science 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