{"id":29779,"date":"2024-02-26T17:39:16","date_gmt":"2024-02-26T09:39:16","guid":{"rendered":"http:\/\/www.biocloudservice.com\/wordpress\/?p=29779"},"modified":"2024-02-26T17:39:18","modified_gmt":"2024-02-26T09:39:18","slug":"pymol%e5%bc%80%e6%ba%90%e7%89%88%e5%ae%89%e8%a3%85%ef%bc%8c%e7%9c%9f%c2%b7%e4%bf%9d%e5%a7%86%e7%ba%a7%e6%95%99%e7%a8%8b","status":"publish","type":"post","link":"http:\/\/www.biocloudservice.com\/wordpress\/?p=29779","title":{"rendered":"PyMol\u5f00\u6e90\u7248\u5b89\u88c5\uff0c\u771f\u00b7\u4fdd\u59c6\u7ea7\u6559\u7a0b"},"content":{"rendered":"

PyMol\u5f00\u6e90\u7248\u5b89\u88c5\uff0c\u771f\u00b7\u4fdd\u59c6\u7ea7\u6559\u7a0b<\/p>\n

\u6700\u8fd1\u5c0f\u679c\u88ab\u8feb<\/s>\u5fc3\u8840\u6765\u6f6e\uff0c\u60f3\u8981\u5b66\u4e60\u4e00\u4e0bPyMol\uff0c\u4e8e\u662f\u5bfb\u627e\u5b89\u88c5\u6559\u7a0b\uff0c\u6839\u636e\u7f51\u7edc\u4e0a\u5206\u4eab\u7684\u6559\u7a0b\u4ecd\u7136\u9047\u5230\u4e86\u4e00\u4e9b\u95ee\u9898\uff0c\u6700\u540e\u7ec8\u4e8e\u89e3\u51b3\u4e86\uff0c\u9644\u4e0a\u7f51\u7edc\u6559\u7a0b\u3002<\/p>\n

https:\/\/www.novopro.cn\/articles\/201906121184.html<\/a><\/p>\n

Windows Install – PyMOLWiki<\/a><\/p>\n

https:\/\/zhuanlan.zhihu.com\/p\/445485729<\/a><\/p>\n

\u5982\u679c\u4f60\u4ecd\u7136\u89e3\u51b3\u4e0d\u4e86\uff0c\u5c31\u770b\u770b\u5c0f\u679c\u7684\u5427\uff0c\u5e0c\u671b\u80fd\u5e2e\u5230\u4f60\u54e6~<\/p>\n

    \n
  1. \u5b89\u88c5python<\/li>\n<\/ol>\n

    \u8fdb\u5165\u5b98\u7f51\uff08https:\/\/www.python.org\/downloads\/windows\/<\/a>\uff09\uff0c\u9009\u62e9\u5408\u9002\u7684\u7248\u672c\uff0c\u5c0f\u679c\u4e0b\u8f7d\u7684\u662f\u6700\u65b0\u7248\u672c3.11.2<\/p>\n

    \u4e0b\u8f7d\u5b8c\u6210\u540e\u5b89\u88c5\u5728\u60f3\u8981\u7684\u4f4d\u7f6e\uff0c\u5c0f\u679c\u5b89\u88c5\u5728\u4e86D:\\python\uff0c\u5b89\u88c5\u8fc7\u7a0b\u4e00\u76f4next\u5c31\u53ef\u4ee5\u4e86<\/p>\n

      \n
    1. \u5b89\u88c5pip<\/li>\n<\/ol>\n

      \u6309\u4e0bwin+R\uff0c\u8f93\u5165cmd\u6253\u5f00windows\u7ec8\u7aef\uff0c\u8f93\u5165\u4ee5\u4e0b\u547d\u4ee4\u68c0\u67e5python\u662f\u5426\u5df2\u7ecf\u5b89\u88c5\u3002<\/p>\n

      python –version<\/p>\n

      <\/p>\n

      \u5982\u679cPython\u5df2\u6210\u529f\u5b89\u88c5\uff0c\u5b83\u4f1a\u663e\u793aPython\u7684\u7248\u672c\u53f7\u3002\u5982\u679c\u663e\u793a\u51fa\u9519\u4fe1\u606f\uff0c\u90a3\u4e48\u53ef\u80fd\u662fPython\u6ca1\u6709\u6b63\u786e\u5730\u5b89\u88c5\u6216\u6ca1\u6709\u6dfb\u52a0\u5230\u73af\u5883\u53d8\u91cf\u4e2d\u3002<\/p>\n

      \u5982\u679cPython\u5df2\u7ecf\u5b89\u88c5\uff0c\u4f60\u53ef\u4ee5\u5728\u7ec8\u7aef\u8f93\u5165\u4ee5\u4e0b\u547d\u4ee4\u6765\u5b89\u88c5pip\uff08\u5982\u679c\u51fa\u73b0\u9519\u8bef\u53ef\u80fd\u662f\u56e0\u4e3a\u4f60\u662f\u5728Python\u89e3\u91ca\u5668\u4ea4\u4e92\u6a21\u5f0f\u4e0b\u76f4\u63a5\u8f93\u5165\u4e86\u547d\u4ee4\u884c\u547d\u4ee4\uff0c\u8fd9\u65f6\u5019\u8f93\u5165exit()\u9000\u51fa\u5373\u53ef<\/p>\n

      python -m ensurepip –default-pip<\/p>\n

      \u5b89\u88c5\u5b8c\u6210\u540e\uff0c\u4f7f\u7528\u4ee5\u4e0b\u547d\u4ee4\u6765\u9a8c\u8bc1pip\u662f\u5426\u6210\u529f\u5b89\u88c5\uff1a<\/p>\n

      pip –version<\/p>\n

      \u5982\u679c\u5b89\u88c5\u6210\u529f\u4f1a\u663e\u793a\u7248\u672c\u53f7\uff1a<\/p>\n

      <\/p>\n

        \n
      1. \u4e0b\u8f7dPymol\u7684wheel\u6587\u4ef6<\/li>\n<\/ol>\n

        \u901a\u8fc7\u7f51\u5740\uff08Archived: Python Extension Packages for Windows – Christoph Gohlke (uci.edu)<\/a>\u4e0b\u8f7dPymol\u7684wheel\u6587\u4ef6\u4ee5\u53ca\u5fc5\u987b\u7684wheel\u6587\u4ef6\uff0c\u5e76\u5c06\u4e0b\u8f7d\u597d\u76843\u4e2a\u6587\u4ef6\u653e\u5728\u4e00\u4e2a\u82f1\u6587\u8def\u5f84\u4e0b\u7684\u6587\u4ef6\u5939\u4e2d\uff0c\u5982\u4e0b\u56fe\uff1a<\/p>\n

        <\/p>\n

          \n
        1. \u5f00\u59cb\u5b89\u88c5PyMol<\/li>\n<\/ol>\n

          \u5728\u7ec8\u7aef\u4f9d\u6b21\u8f93\u5165\u4ee5\u4e0b\u4ee3\u7801\u8fdb\u884c\u5b89\u88c5\uff1a<\/p>\n

          python -m pip install D:\/PyMOL_installation\/numpy-1.22.4+vanilla-cp311-cp311-win_amd64.whl<\/p>\n

          python -m pip install D:\/PyMOL_installation\/pymol-2.6.0a0-cp311-cp311-win_amd64.whl<\/p>\n

          python -m pip install D:\/PyMOL_installation\/pymol_launcher-2.5-cp311-cp311-win_amd64.whl<\/p>\n

          \u6700\u540e\u663e\u793a\u6210\u529f\u3002<\/p>\n

          <\/p>\n

          \u5728python\u5b89\u88c5\u4f4d\u7f6e\u627e\u5230Scripts\u6587\u4ef6\uff0c\u6253\u5f00\u5c31\u80fd\u770b\u5230PyMol\u4e86\uff0c\u53ef\u4ee5\u5728\u684c\u9762\u521b\u5efa\u4e00\u4e2a\u5feb\u6377\u65b9\u5f0f\u65b9\u4fbf\u4f7f\u7528<\/p>\n

          <\/p>\n

          <\/p>\n

          \u5e0c\u671b\u5c0f\u679c\u80fd\u5e2e\u5230\u4f60\u54e6\uff01<\/p>\n

          \u6709\u5176\u4ed6\u5206\u6790\u9700\u6c42\u53ef\u4ee5\u770b\u770b\u8fd9\u91cc\uff1a\u4e91\u751f\u4fe1 \u00a0– \u5b66\u751f\u7269\u4fe1\u606f\u5b66 (biocloudservice.com)<\/a><\/p>\n

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

          PyMol\u5f00\u6e90\u7248\u5b89\u88c5\uff0c\u771f\u00b7\u4fdd\u59c6\u7ea7\u6559\u7a0b \u6700\u8fd1\u5c0f\u679c\u88ab\u8feb\u5fc3\u8840\u6765\u6f6e\uff0c\u60f3\u8981\u5b66\u4e60\u4e00\u4e0bPyMol\uff0c\u4e8e\u662f\u5bfb\u627e\u5b89\u88c5\u6559\u7a0b\uff0c\u6839\u636e\u7f51\u7edc […]<\/p>\n","protected":false},"author":1,"featured_media":0,"comment_status":"closed","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"jetpack_post_was_ever_published":false,"_jetpack_newsletter_access":""},"categories":[1],"tags":[],"jetpack_featured_media_url":"","_links":{"self":[{"href":"http:\/\/www.biocloudservice.com\/wordpress\/index.php?rest_route=\/wp\/v2\/posts\/29779"}],"collection":[{"href":"http:\/\/www.biocloudservice.com\/wordpress\/index.php?rest_route=\/wp\/v2\/posts"}],"about":[{"href":"http:\/\/www.biocloudservice.com\/wordpress\/index.php?rest_route=\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"http:\/\/www.biocloudservice.com\/wordpress\/index.php?rest_route=\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"http:\/\/www.biocloudservice.com\/wordpress\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=29779"}],"version-history":[{"count":1,"href":"http:\/\/www.biocloudservice.com\/wordpress\/index.php?rest_route=\/wp\/v2\/posts\/29779\/revisions"}],"predecessor-version":[{"id":29794,"href":"http:\/\/www.biocloudservice.com\/wordpress\/index.php?rest_route=\/wp\/v2\/posts\/29779\/revisions\/29794"}],"wp:attachment":[{"href":"http:\/\/www.biocloudservice.com\/wordpress\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=29779"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"http:\/\/www.biocloudservice.com\/wordpress\/index.php?rest_route=%2Fwp%2Fv2%2Fcategories&post=29779"},{"taxonomy":"post_tag","embeddable":true,"href":"http:\/\/www.biocloudservice.com\/wordpress\/index.php?rest_route=%2Fwp%2Fv2%2Ftags&post=29779"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}