{"id":1195,"date":"2017-09-22T00:04:46","date_gmt":"2017-09-21T16:04:46","guid":{"rendered":"http:\/\/ercis.ustb.edu.cn\/?p=1195"},"modified":"2017-09-22T00:04:46","modified_gmt":"2017-09-21T16:04:46","slug":"%e6%95%b0%e5%80%bc%e5%a0%86%e9%a1%b9%e7%9b%ae%e6%9d%90%e6%96%99%e4%b8%93%e4%b8%9a%e7%bb%84%e7%ac%ac1%e6%ac%a1%e4%be%8b%e4%bc%9a%e4%bc%9a%e8%ae%ae%e7%ba%aa%e8%a6%81","status":"publish","type":"post","link":"http:\/\/ercis.ustb.edu.cn\/?p=1195","title":{"rendered":"2017\u5e749\u670822\u65e5\u6570\u503c\u5806\u9879\u76ee\u6750\u6599\u4e13\u4e1a\u7ec4\u7ec4\u4f1a"},"content":{"rendered":"

\u65f6\u95f4\uff1a<\/strong>2017\u5e749\u670822\u65e5<\/p>\n

\u5730\u70b9\uff1a<\/strong>\u539f\u5b50\u80fd\u9662\u5355\u6676\u7845\u5c0f\u697c\u4e8c\u697c\u4f1a\u8bae\u5ba4<\/p>\n

<\/p>\n

\u8ba8\u8bba\u5185\u5bb9\uff1a<\/strong><\/p>\n

\u8d3a\u65b0\u798f\u8001\u5e08\u9488\u5bf9\u6570\u503c\u53cd\u5e94\u5806\u2014\u2014\u6750\u6599\u90e8\u5206\u7814\u7a76\u5185\u5bb9\u4f5c\u4e86\u8be6\u7ec6\u4ecb\u7ecd\uff0c\u4e3b\u8981\u5173\u5fc3\u95ee\u9898\u5305\u62ec\uff1aRPV\u8f90\u7167\u8106\u5316\uff0c\u5806\u5185\u6784\u4ef6\u8f90\u7167\u80bf\u80c0\uff0c\u9506\u5305\u58f3\u5438\u6c22\u673a\u7406\u3002<\/p>\n

\u5206\u522b\u9488\u5bf9RPV\u94a2\u8f90\u7167\u8106\u5316\u548c\u5806\u5185\u6784\u4ef6\u8f90\u7167\u80bf\u80c0\u8bbe\u8ba1\u8be6\u7ec6\u7684\u7814\u7a76\u8def\u7ebf\uff0c\u5206\u6790\u5df2\u6709\u5de5\u4f5c\u57fa\u7840\uff0c\u603b\u7ed3\u51fa\u672c\u9879\u76ee\u56db\u5927\u4e3b\u8981\u5185\u5bb9\uff1a<\/p>\n

    \n
  1. CrystalMD\u7684\u8fdb\u4e00\u6b65\u5b8c\u5584\u548c\u4f18\u5316\uff08\u5b58\u5728\u7684\u95ee\u9898\u3001\u7ea7\u8054\u78b0\u649e\u529f\u80fd\u7684\u4f18\u5316\uff09\uff1b<\/li>\n
  2. CrystalKMC\u8f6f\u4ef6\u7684\u8fdb\u4e00\u6b65\u5b8c\u5584\u548c\u4f18\u5316\uff08\u6a21\u578b\u53ca\u7b97\u6cd5\uff1f\u5d4c\u5165\u5f0f\u8026\u5408\uff1f\u95f4\u9699\uff1f\uff09<\/li>\n
  3. \u975e\u5e73\u5747\u573a\u901f\u7387\u7406\u8bba\u7a0b\u5e8f\u7684\u5f00\u53d1\u53ca\u5e76\u884c\u5316\uff08\u7269\u7406\u6a21\u578b\uff1b\u6570\u5b66\u6c42\u89e3\uff1b\u5e76\u884c\u5316\uff09<\/li>\n
  4. \u76f8\u573a\u7a0b\u5e8f\u5f00\u53d1\uff08\u80bf\u80c0\u3001\u6790\u51fa\uff1b\u7269\u7406\u6a21\u578b\uff09<\/li>\n<\/ol>\n

    \u5176\u4e2d\uff0c\u9488\u5bf9CrystalMD\uff0c\u9700\u8981\u5b8c\u5584\u7684\u529f\u80fd\u6709\uff1a<\/p>\n

    \uff081\uff09\u6784\u9020\u4e0d\u540c\u6676\u5411\u7684box\u6216\u8005\u4ece\u5916\u90e8\u8bfb\u5165\u5176\u5b83box\u7c7b\u578b<\/p>\n

    \uff082\uff09\u76ee\u524dCrstalMD\u4ec5\u53ef\u6a21\u62dfNVE\u7cfb\u7efc\uff0c\u9700\u8981\u8003\u8651\u52a0\u5165NPT\uff0cNVT\u7b49\u5176\u5b83\u7cfb\u7efc<\/p>\n

    \uff083\uff09\u6a21\u62df\u65f6\u95f4\u6b65\u957f\u5e94\u53ef\u8c03\u8282\u3001\u53ef\u63a7\u5236<\/p>\n

    \uff084\uff09\u9700\u8003\u8651\u52a0\u5165\u7f3a\u9677\u5206\u6790\u65b9\u6cd5<\/p>\n

    \uff085\uff09\u76ee\u524dcascade\u4ec5\u80fd\u5b9e\u73b0\u4e00\u6b21\u4e00\u4e2aPKA\u8ba1\u7b97\uff0c\u53ef\u8003\u8651\u52a0\u5165\u5bf9\u591a\u79cdPKA\u8c31\u8ba1\u7b97<\/p>\n

    \uff086\uff09\u662f\u5426\u8003\u8651\u5b9e\u73b0\u52a0\u901fMD\u529f\u80fd<\/p>\n

    \uff087\uff09\u672c\u9879\u76ee\u6e56\u5357\u5927\u5b66\u63d0\u4f9b\u52bf\u51fd\u6570\u4e3aMEAM\u52bf\uff0c\u4f1a\u5f71\u54cd\u8ba1\u7b97\u6548\u7387\uff0c\u5982\u4f55\u89e3\u51b3\u4f18\u5316\uff1f<\/p>\n

    CrystalKMC\u8f6f\u4ef6\u9700\u8981\u5b8c\u5584\u7684\u529f\u80fd\u548c\u89e3\u51b3\u7684\u95ee\u9898\u6709\uff1a<\/p>\n

    \uff081\uff09\u73b0\u6709\u6a21\u578b\u4ec5\u8003\u8651\u7a7a\u4f4d\u548c\u6eb6\u8d28\u539f\u5b50\u6269\u6563\u673a\u5236\uff0c\u672a\u8003\u8651\u95f4\u9699\u539f\u5b50\u6269\u6563\u673a\u5236\uff1b<\/p>\n

    \uff082\uff09\u5982\u4f55\u5b9e\u73b0MD\u548cKMC\u5d4c\u5165\u5f0f\u8026\u5408\uff0c\u6210\u4e3a\u4e00\u4e2a\u8f6f\u4ef6\uff1f<\/p>\n

    \uff083\uff09\u6d4b\u8bd5\u8fc7\u7a0b\u4e2d\u53d1\u73b0\u7a7a\u4f4d\u4f18\u5148\u805a\u96c6\uff0c\u5b9e\u9645\u7269\u7406\u8fc7\u7a0b\u662f\u7a7a\u4f4d\u548c\u6eb6\u8d28\u539f\u5b50\u4e00\u8d77\u805a\u96c6<\/p>\n

    \uff084\uff09\u6a21\u62df\u65f6\u95f4\u8f83\u957f\u65f6\uff0c\u4f53\u7cfb\u51e0\u4e4e\u65e0\u53d8\u5316\uff1f<\/p>\n

     <\/p>\n

    \u7ed3\u8bba\u548c\u884c\u52a8\u9879\uff1a<\/strong><\/p>\n

    \u9488\u5bf9\u672c\u6b21\u8ba8\u8bba\u5185\u5bb9\u548c\u5b9e\u65bd\u65b9\u6848\u64b0\u5199\u8981\u6c42\uff0c\u62df\u5f00\u5c55\u7684\u884c\u52a8\u9879\u6709\uff1a<\/p>\n

      \n
    • \u4f18\u5148\u5f00\u5c55\u5b9e\u65bd\u65b9\u6848\u64b0\u5199\uff08\u539f\u5b50\u80fd\u9662\u8d3e\u4e3d\u971e\u8d1f\u8d23\u7269\u7406\u6a21\u578b\u548c\u793a\u8303\u5e94\u7528\uff0c\u7f51\u7edc\u4e2d\u5fc3\u5f20\u535a\u5c27\u8d1f\u8d23\u5e76\u884c\u7b97\u6cd5\u4f18\u5316\uff0c\u5317\u79d1\u5927\u9648\u4e39\u4e39\u8d1f\u8d23\u8f6f\u4ef6\u5f00\u53d1\uff09\uff0c09.28\u6c47\u603b\u5230\u8d3e\u4e3d\u971e\u5904\uff1b<\/li>\n
    • \u9488\u5bf9\u56db\u4e2a\u8f6f\u4ef6\u5f00\u53d1\uff0c\u5206\u56db\u4e2a\u5c0f\u7ec4\uff0c\u6bcf\u7ec4\u6210\u5458\u5982\u4e0b\uff1a<\/li>\n<\/ul>\n

      MD\uff1a\u7f51\u7edc\u4e2d\u5fc3\uff08\u5f20\u535a\u5c27\uff09+\u539f\u5b50\u80fd\u9662\uff08\u8d3a\u65b0\u798f\u3001\u66f9\u6657\u3001\u8c46\u8273\u5764\uff09+\u5317\u79d1\u5927\uff08\u9648\u4e39\u4e39\uff09<\/p>\n

      KMC\uff1a\u8ba1\u7b97\u6240\uff08\u674e\u58eb\u521a\uff09+\u7f51\u7edc\u4e2d\u5fc3\uff08\u5f20\u535a\u5c27\uff09+\u539f\u5b50\u80fd\u9662\uff08\u8d3a\u65b0\u798f\u3001\u8d3e\u4e3d\u971e\u3001\u738b\u4e1c\u6770\uff09+\u5317\u79d1\u5927\uff08\u6c6a\u4e3d\u6885\uff09<\/p>\n

      RT\uff1a\u7f51\u7edc\u4e2d\u5fc3\uff08\u8042\u5b81\u660e\uff09+\u539f\u5b50\u80fd\u9662\uff08\u8d3a\u65b0\u798f\u3001\u5434\u77f3\uff09+\u5317\u79d1\u5927\uff08\uff09<\/p>\n

      PF\uff1a\u7f51\u7edc\u4e2d\u5fc3\uff08\u5468\u7eaf\u8446\uff09+\u539f\u5b50\u80fd\u9662\uff08\u8d3a\u65b0\u798f\u3001\u738b\u4e1c\u6770\uff09+\u5317\u79d1\u5927\uff08\uff09<\/p>\n

        \n
      • \u4e8e17\u65e5\u4e3e\u884c\u7b2c\u4e8c\u6b21\u4f1a\u8bae\uff0c<\/li>\n<\/ul>\n

        \u5f20\u535a\u5c27\uff0c\u9488\u5bf9CrystalMD\u9700\u5b8c\u5584\u7684\u529f\u80fd\uff0c\u5c55\u5f00\u8c03\u7814\u3001\u5206\u6790\uff0c\u4f5c\u62a5\u544a<\/p>\n

        \u674e\u58eb\u521a\uff0c\u9488\u5bf9CrystalKMC\u9700\u5b8c\u5584\u7684\u529f\u80fd\uff0c\u5c55\u5f00\u8c03\u7814\u3001\u5206\u6790\uff0c\u4f5c\u62a5\u544a<\/p>\n

        \u8d3e\u4e3d\u971e\u3001\u738b\u4e1c\u6770\uff0c\u9488\u5bf9KMC\u4e2d\u5982\u4f55\u5f15\u5165\u95f4\u9699\u673a\u5236\uff0c\u5c55\u5f00\u8c03\u7814\u3001\u5206\u6790\uff0c\u4f5c\u62a5\u544a<\/p>\n

         <\/p>\n","protected":false},"excerpt":{"rendered":"

        \u65f6\u95f4\uff1a2017\u5e749\u670822\u65e5 \u5730\u70b9\uff1a\u539f\u5b50\u80fd\u9662\u5355\u6676\u7845\u5c0f\u697c\u4e8c\u697c\u4f1a\u8bae\u5ba4<\/p>\n","protected":false},"author":5,"featured_media":0,"comment_status":"open","ping_status":"open","sticky":false,"template":"","format":"standard","meta":{"cybocfi_hide_featured_image":"","_links_to":"","_links_to_target":""},"categories":[13],"tags":[20],"_links":{"self":[{"href":"http:\/\/ercis.ustb.edu.cn\/index.php?rest_route=\/wp\/v2\/posts\/1195"}],"collection":[{"href":"http:\/\/ercis.ustb.edu.cn\/index.php?rest_route=\/wp\/v2\/posts"}],"about":[{"href":"http:\/\/ercis.ustb.edu.cn\/index.php?rest_route=\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"http:\/\/ercis.ustb.edu.cn\/index.php?rest_route=\/wp\/v2\/users\/5"}],"replies":[{"embeddable":true,"href":"http:\/\/ercis.ustb.edu.cn\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=1195"}],"version-history":[{"count":0,"href":"http:\/\/ercis.ustb.edu.cn\/index.php?rest_route=\/wp\/v2\/posts\/1195\/revisions"}],"wp:attachment":[{"href":"http:\/\/ercis.ustb.edu.cn\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=1195"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"http:\/\/ercis.ustb.edu.cn\/index.php?rest_route=%2Fwp%2Fv2%2Fcategories&post=1195"},{"taxonomy":"post_tag","embeddable":true,"href":"http:\/\/ercis.ustb.edu.cn\/index.php?rest_route=%2Fwp%2Fv2%2Ftags&post=1195"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}