{"id":5688,"date":"2025-03-17T18:09:10","date_gmt":"2025-03-17T10:09:10","guid":{"rendered":"https:\/\/www.edumails.cn\/?p=5688"},"modified":"2025-03-17T18:11:07","modified_gmt":"2025-03-17T10:11:07","slug":"cgenff","status":"publish","type":"post","link":"https:\/\/www.edumails.cn\/en\/cgenff.html","title":{"rendered":"cgenff\u529b\u573a\u53c2\u6570\u5728\u7ebf\u751f\u6210\u5de5\u5177\u7f51\u7ad9\u8d26\u53f7edu\u90ae\u7bb1\u6ce8\u518c\u7533\u8bf7\u6559\u7a0b"},"content":{"rendered":"<p><img loading=\"lazy\" class=\"aligncenter\" src=\"https:\/\/img.list68.cn\/2025\/cgenff\/logo.jpg\" width=\"862\" height=\"416\" \/><\/p>\n<h1>Introduction<\/h1>\n<p>CGenFF\uff08CHARMM General Force Field\uff09cgenff.com\u662f\u4e00\u4e2a\u7528\u4e8e\u5206\u5b50\u52a8\u529b\u5b66\u6a21\u62df\u7684\u529b\u573a\u53c2\u6570\u751f\u6210\u5de5\u5177\uff0c\u4e3b\u8981\u670d\u52a1\u4e8eCHARMM\uff08Chemistry at HARvard Macromolecular Mechanics\uff09\u8f6f\u4ef6\u7528\u6237\u3002\u8be5\u7f51\u7ad9\u65e8\u5728\u4e3a\u7814\u7a76\u4eba\u5458\u63d0\u4f9b\u4e00\u79cd\u7b80\u4fbf\u7684\u65b9\u6cd5\uff0c\u751f\u6210\u9002\u7528\u4e8eCHARMM\u529b\u573a\u7684\u53c2\u6570\uff0c\u7279\u522b\u662f\u9488\u5bf9\u90a3\u4e9b\u5c1a\u672a\u88ab\u6807\u51c6\u529b\u573a\u8986\u76d6\u7684\u5206\u5b50\u6216\u5316\u5b66\u7ed3\u6784\u3002\u7528\u6237\u53ef\u4ee5\u901a\u8fc7\u8f93\u5165\u5206\u5b50\u7684\u5316\u5b66\u7ed3\u6784\uff08\u901a\u5e38\u4ee5SMILES\u5b57\u7b26\u4e32\u6216\u5206\u5b50\u6587\u4ef6\u683c\u5f0f\u4e0a\u4f20\uff09\uff0c\u81ea\u52a8\u751f\u6210\u9002\u7528\u4e8eCHARMM\u529b\u573a\u7684\u53c2\u6570\u3002\u8fd9\u4e9b\u53c2\u6570\u5305\u62ec\u952e\u957f\u3001\u952e\u89d2\u3001\u4e8c\u9762\u89d2\u3001\u9759\u7535\u7535\u8377\u7b49\u3002CGenFF\u7684\u6838\u5fc3\u7b97\u6cd5\u57fa\u4e8e\u91cf\u5b50\u5316\u5b66\u8ba1\u7b97\u548c\u7ecf\u9a8c\u89c4\u5219\uff0c\u80fd\u591f\u4e3a\u65b0\u5206\u5b50\u751f\u6210\u5408\u7406\u7684\u529b\u573a\u53c2\u6570\u3002<\/p>\n<p>\u968f\u7740\u8ba1\u7b97\u5316\u5b66\u548c\u5206\u5b50\u52a8\u529b\u5b66\u6a21\u62df\u6280\u672f\u7684\u4e0d\u65ad\u53d1\u5c55\uff0cCGenFF\u4e5f\u5728\u4e0d\u65ad\u66f4\u65b0\u548c\u6539\u8fdb\u3002\u672a\u6765\u7684\u7248\u672c\u53ef\u80fd\u4f1a\u652f\u6301\u66f4\u591a\u7c7b\u578b\u7684\u5206\u5b50\u7ed3\u6784\uff0c\u5e76\u63d0\u4f9b\u66f4\u7cbe\u786e\u7684\u53c2\u6570\u751f\u6210\u7b97\u6cd5\u3002\u6b64\u5916\uff0c\u968f\u7740\u673a\u5668\u5b66\u4e60\u548c\u4eba\u5de5\u667a\u80fd\u6280\u672f\u7684\u5f15\u5165\uff0cCGenFF\u6709\u671b\u8fdb\u4e00\u6b65\u63d0\u9ad8\u53c2\u6570\u751f\u6210\u7684\u81ea\u52a8\u5316\u6c34\u5e73\u548c\u51c6\u786e\u6027\u3002<\/p>\n<h1>Website Registration<\/h1>\n<p>\u6211\u4eec\u6253\u5f00https:\/\/cgenff.com\/\u70b9\u51fb\u7f51\u9875\u53f3\u4e0a\u89d2Create Account\u521b\u5efa\u8d26\u53f7\u5982\u4e0b\u56fe\u6240\u793a\uff1a<\/p>\n<p><img loading=\"lazy\" class=\"aligncenter\" src=\"https:\/\/img.list68.cn\/2025\/cgenff\/0.jpg\" width=\"799\" height=\"196\" \/><\/p>\n<p>\u8df3\u8f6c\u5230\u8d26\u53f7\u6ce8\u518c\u9875\u9762\uff1ahttps:\/\/app.cgenff.com\/login\u00a0 \u00a0 \u6211\u4eec\u8981\u9009\u62e9Academia\u5b66\u672f\u7c7b\u578b\uff0c\u4f7f\u7528\u7f8e\u56fdedu\u90ae\u7bb1\u8fdb\u884c\u6ce8\u518c\uff1a<\/p>\n<p>Email Address \u586b\u5199\u5b66\u672f\u7535\u5b50\u90ae\u4ef6\u5730\u5740\uff0c\u6839\u636e\u6d4b\u8bd5\u53cd\u9988\u53ea\u6709\u7f8e\u56fd.edu\u5b66\u672f\u90ae\u7bb1\u6ce8\u518c\u624d\u4e0d\u4f1a\u51fa\u73b0\u62a5\u9519\u3002<\/p>\n<p>First Name\u548cLast Name\u90e8\u5206\u968f\u4fbf\u586b\uff0cInstitution Name \u90e8\u5206\u586b\u5199\u5b66\u672f\u673a\u6784\u7684\u82f1\u6587\u5168\u79f0\u3002Country\u9009\u62e9\u56fd\u5bb6\u3002<\/p>\n<p><img loading=\"lazy\" class=\"aligncenter\" src=\"https:\/\/img.list68.cn\/2025\/cgenff\/1.jpg\" width=\"804\" height=\"479\" \/><\/p>\n<p>Read our Cloud Services Agreement\u9605\u8bfb\u6211\u4eec\u7684\u4e91\u670d\u52a1\u534f\u8bae \u6211\u4eec\u70b9\u51fb\u540e\uff0c\u518d\u9009\u62e9\u4e0b\u9762I have read and agreed to the Cloud Services Agreement\u2009*\u6211\u5df2\u9605\u8bfb\u5e76\u540c\u610f\u4e91\u670d\u52a1\u534f\u8bae\u2009* \u70b9\u51fbCreate Account\uff0c\u63d0\u793a\u53d1\u9001\u7535\u5b50\u90ae\u4ef6\u3002<\/p>\n<h1>Successful registration<\/h1>\n<p>\u6211\u4eec\u6253\u5f00edu\u90ae\u7bb1\u5c31\u6536\u5230\u6765\u81easupport@cgenff.com\u53d1\u9001\u7684\u6807\u9898\u4e3a\uff1a\u201c<strong>CGenFF Web App Email Verification &#8211; Will expire after 24-48 hours<\/strong>\u201dCGenFF Web \u5e94\u7528\u7a0b\u5e8f\u7535\u5b50\u90ae\u4ef6\u9a8c\u8bc1 &#8211; \u5c06\u5728 24-48 \u5c0f\u65f6\u540e\u8fc7\u671f\u3002<\/p>\n<p><img loading=\"lazy\" class=\"aligncenter\" src=\"https:\/\/img.list68.cn\/2025\/cgenff\/2.jpg\" width=\"821\" height=\"434\" \/><\/p>\n<blockquote>\n<p data-olk-copy-source=\"MessageBody\">Hello,Follow this link to verify your email address.<\/p>\n<p><a rel=\"nofollow\" id=\"LPlnk610831\" title=\"https:\/\/cgenff-prod.firebaseapp.com\/__\/auth\/action?mode=verifyEmail&amp;oobCode=qgD0ctsy7tQ_OE-IrI7RJtUL9CG98caFRWHQwAGPfq8AAAGVo3e1YA&amp;apiKey=AIzaSyA_k5QDKh2dAZLzcg9MsG4tB_BfSIiEGJw&amp;continueUrl=https%3A%2F%2Fapp.cgenff.com%2Flogin&amp;lang=en\" href=\"https:\/\/cgenff-prod.firebaseapp.com\/__\/auth\/action?mode=verifyEmail&amp;oobCode=qgD0ctsy7tQ_OE-IrI7RJtUL9CG98caFRWHQwAGPfq8AAAGVo3e1YA&amp;apiKey=AIzaSyA_k5QDKh2dAZLzcg9MsG4tB_BfSIiEGJw&amp;continueUrl=https%3A%2F%2Fapp.cgenff.com%2Flogin&amp;lang=en\" target=\"_blank\" data-auth=\"NotApplicable\" data-linkindex=\"0\">https:\/\/cgenff-prod.firebaseapp.com\/__\/auth\/action?mode=verifyEmail&amp;oobCode=qgD0ctsy7tQ_OE-<\/a><\/p>\n<p>If you didn&#8217;t ask to verify this address, you can ignore this email.Thanks,Your CGenFF Web App team<\/p><\/blockquote>\n<p><img loading=\"lazy\" class=\"aligncenter\" src=\"https:\/\/img.list68.cn\/2025\/cgenff\/3.jpg\" width=\"816\" height=\"360\" \/><\/p>\n<p>Your email has been verified\uff0cYou can now sign in with your new account\u60a8\u7684\u7535\u5b50\u90ae\u4ef6\u5df2\u9a8c\u8bc1\uff0c\u60a8\u73b0\u5728\u53ef\u4ee5\u4f7f\u7528\u65b0\u5e10\u6237\u767b\u5f55\u3002<\/p>\n<p><img loading=\"lazy\" class=\"aligncenter\" src=\"https:\/\/img.list68.cn\/2025\/cgenff\/4.jpg\" width=\"808\" height=\"366\" \/><\/p>","protected":false},"excerpt":{"rendered":"<p>\u524d\u8a00\u4ecb\u7ecd CGenFF\uff08CHARMM General Force Field\uff09cgenff.com\u662f\u4e00\u4e2a\u7528\u4e8e\u5206\u5b50\u52a8\u529b\u5b66\u6a21\u62df\u7684\u529b\u573a\u53c2\u6570\u751f\u6210\u5de5\u5177\uff0c\u4e3b\u8981\u670d\u52a1\u4e8eCHARMM\uff08Chemistry at HARvard Macromolecular M&#8230;<\/p>","protected":false},"author":1,"featured_media":0,"comment_status":"open","ping_status":"open","sticky":false,"template":"","format":"standard","meta":[],"categories":[2687],"tags":[2925,2923,3068,3065,3064,2924,3066,3067,991,1241],"topic":[],"_links":{"self":[{"href":"https:\/\/www.edumails.cn\/en\/wp-json\/wp\/v2\/posts\/5688"}],"collection":[{"href":"https:\/\/www.edumails.cn\/en\/wp-json\/wp\/v2\/posts"}],"about":[{"href":"https:\/\/www.edumails.cn\/en\/wp-json\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"https:\/\/www.edumails.cn\/en\/wp-json\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"https:\/\/www.edumails.cn\/en\/wp-json\/wp\/v2\/comments?post=5688"}],"version-history":[{"count":1,"href":"https:\/\/www.edumails.cn\/en\/wp-json\/wp\/v2\/posts\/5688\/revisions"}],"predecessor-version":[{"id":5689,"href":"https:\/\/www.edumails.cn\/en\/wp-json\/wp\/v2\/posts\/5688\/revisions\/5689"}],"wp:attachment":[{"href":"https:\/\/www.edumails.cn\/en\/wp-json\/wp\/v2\/media?parent=5688"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"https:\/\/www.edumails.cn\/en\/wp-json\/wp\/v2\/categories?post=5688"},{"taxonomy":"post_tag","embeddable":true,"href":"https:\/\/www.edumails.cn\/en\/wp-json\/wp\/v2\/tags?post=5688"},{"taxonomy":"topic","embeddable":true,"href":"https:\/\/www.edumails.cn\/en\/wp-json\/wp\/v2\/topic?post=5688"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}