{"id":2365,"date":"2023-01-06T13:28:56","date_gmt":"2023-01-06T04:28:56","guid":{"rendered":"https:\/\/www.insilico.jp\/blog\/?p=2365"},"modified":"2023-01-06T14:14:29","modified_gmt":"2023-01-06T05:14:29","slug":"cmake03","status":"publish","type":"post","link":"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/","title":{"rendered":"RDKit\u3092\u5229\u7528\u3059\u308bC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306eCMake\u306b\u3088\u308b\u30d3\u30eb\u30c9"},"content":{"rendered":"\n<h2 class=\"wp-block-heading\">\u306f\u3058\u3081\u306b<\/h2>\n\n\n\n<p>\u4eca\u56de\u306e\u8a71\u984c\u306fRDKit\u3092\u5229\u7528\u3057\u305fC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306b\u3064\u3044\u3066CMake\u3092\u9069\u7528\u3057\u3088\u3046\u3068\u601d\u3044\u307e\u3059\u3002\u4eca\u307e\u3067CMake\u306b\u3064\u3044\u30662\u56de\u30d6\u30ed\u30b0\u3092\u66f8\u304d\u307e\u3057\u305f\u304c\u3001\u5b9f\u306f\u3053\u306e\u8a71\u3092\u30d6\u30ed\u30b0\u306b\u3057\u305f\u3044\u304b\u3089\u3067\u3057\u305f\u3002RDKit\u3068\u3044\u3046\u30e9\u30a4\u30d6\u30e9\u30ea\u306fOpenBabel\u306b\u6bd4\u3079\u3066C++\u30d7\u30ed\u30b0\u30e9\u30e0\u306e\u4f5c\u6210\u304c\u9762\u5012\u3067\u3059\u3002OpenBabel\u306f\u30ea\u30f3\u30af\u3059\u3079\u304d\u30e9\u30a4\u30d6\u30e9\u30ea\u306e\u30d5\u30a1\u30a4\u30eb\u304c1\u500b\u3060\u3051\u306a\u306e\u306b\u6bd4\u3079\u3066\u3001RDKit\u306f\u4f55\u5341\u500b\u3082\u3042\u308b\u305f\u3081\u3067\u3059\u3002OpenBabel\u306e\u69d8\u306b1\u884c\u306e\u30b3\u30de\u30f3\u30c9\u3067\u7c21\u5358\u306b\u30d3\u30eb\u30c9\u3059\u308b\u3053\u3068\u306f\u96e3\u3057\u3044\u306e\u3067\u3059\u3002\u305d\u3053\u3067CMake\u306e\u529b\u3092\u501f\u308a\u3066\u7c21\u5358\u306b\u30d3\u30eb\u30c9\u3057\u3088\u3046\u3068\u76ee\u8ad6\u898b\u307e\u3057\u305f\u3002\u4e00\u65e6CMakeLists.txt\u306e\u3072\u306a\u578b\u304c\u51fa\u6765\u308c\u3070\u3001\u4eca\u5f8c\u7d39\u4ecb\u3059\u308bRDKit\u95a2\u9023\u306eC++\u30d7\u30ed\u30b0\u30e9\u30e0\u3092\u7d39\u4ecb\u3057\u3084\u3059\u304f\u306a\u308b\u306e\u3067\u3001\u306a\u308b\u3079\u304f\u5358\u7d14\u306a\u5f62\u306b\u4f5c\u6210\u3057\u3066\u307f\u307e\u3057\u305f\u3002<\/p>\n\n\n\n<h2 class=\"wp-block-heading\">RDKit\u306e\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb<\/h2>\n\n\n\n<p>RDKit\u306e\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u306e\u65b9\u6cd5\u306f\u5e7e\u3064\u304b\u3042\u308a\u307e\u3059\u304c\u3001\u4eca\u56de\u306f\u6700\u3082\u7c21\u5358\u306aMiniconda\u3092\u5229\u7528\u3059\u308b\u65b9\u6cd5\u3092\u7d39\u4ecb\u3057\u307e\u3059\u3002<\/p>\n\n\n\n<h3 class=\"wp-block-heading\">1. Miniconda\u306e\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb<\/h3>\n\n\n\n<p>\u65e2\u306bMiniconda\u3084Anaconda\u304c\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3055\u308c\u3066\u3044\u308b\u5834\u5408\u306f\u3053\u306e\u30b9\u30c6\u30c3\u30d7\u306f\u98db\u3070\u3057\u3066\u304f\u3060\u3055\u3044\u3002Miniconda\u306f\u4ee5\u4e0b\u306eURL\u304b\u3089\u30c0\u30a6\u30f3\u30ed\u30fc\u30c9\u3067\u304d\u307e\u3059\u3002<\/p>\n\n\n\n<p><a href=\"https:\/\/docs.conda.io\/en\/latest\/miniconda.html\">Miniconda<\/a> (https:\/\/docs.conda.io\/en\/latest\/miniconda.html)<\/p>\n\n\n\n<p>&#8220;Miniconda3 Linux 64-bit&#8221;\u3092\u30af\u30ea\u30c3\u30af\u3057\u3066\u62e1\u5f35\u5b50\u304csh\u306e\u30d5\u30a1\u30a4\u30eb\u3092\u30c0\u30a6\u30f3\u30ed\u30fc\u30c9\u3057\u307e\u3059\u3002\u305d\u3057\u3066\u4ee5\u4e0b\u306e\u30b3\u30de\u30f3\u30c9\u3067\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3057\u307e\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>$ sh Miniconda3-latest-Linux-x86_64.sh<\/code><\/pre>\n\n\n\n<p>\u5e7e\u3064\u304b\u8cea\u554f\u3055\u308c\u308b\u304c\u5168\u3066&#8221;Enter&#8221;\u304b&#8221;yes&#8221;\u3068\u7b54\u3048\u307e\u3057\u3087\u3046\u3002\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u7d42\u4e86\u5f8c\u306b\u4ee5\u4e0b\u306e\u30b3\u30de\u30f3\u30c9\u3067\u4eee\u60f3\u74b0\u5883\u3092\u81ea\u52d5\u3067\u6709\u52b9\u5316\u3055\u308c\u308b\u3053\u3068\u3092\u7121\u52b9\u5316\u3059\u308b\u3068\u826f\u3044\u3067\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>$ conda config --set auto_activate_base false<\/code><\/pre>\n\n\n\n<h3 class=\"wp-block-heading\">2. \u4eee\u60f3\u74b0\u5883\u306e\u4f5c\u6210<\/h3>\n\n\n\n<p>RDKit\u7528\u306e\u4eee\u60f3\u74b0\u5883\u3092\u4f5c\u6210\u3057\u307e\u3059\u3002\u4eee\u60f3\u74b0\u5883\u3092\u4f5c\u6210\u3059\u308b\u969b\u306bPython\u306e\u30d0\u30fc\u30b8\u30e7\u30f3\u3082\u9078\u3079\u308b\u306e\u3067\u3059\u304c\u3001\u4eca\u56de\u306f\u5c11\u3057\u524d\u306e\u30d0\u30fc\u30b8\u30e7\u30f3\u3092\u6307\u5b9a\u3057\u307e\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>$ conda create -n rdkit python=3.9<\/code><\/pre>\n\n\n\n<h3 class=\"wp-block-heading\">3. RDKit\u306e\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb<\/h3>\n\n\n\n<p>\u6700\u65b0\u7248\u306eRDKit\u306f\u4ee5\u4e0b\u306e\u30b3\u30de\u30f3\u30c9\u3067\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3057\u307e\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>$ conda install -c conda-forge rdkit<\/code><\/pre>\n\n\n\n<p>\u4ee5\u524d\u306f&#8221;rdkit&#8221;\u3068\u3044\u3046\u30c1\u30e3\u30cd\u30eb\u3092\u5229\u7528\u3057\u3066\u3044\u305f\u306e\u3067\u3059\u304c\u3001\u53e4\u3044\u30d0\u30fc\u30b8\u30e7\u30f3\u3057\u304b\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3067\u304d\u306a\u3044\u306e\u3067\u3001\u4eca\u56de\u306f&#8221;confa-forge&#8221;\u3068\u3044\u3046\u30c1\u30e3\u30cd\u30eb\u3092\u5229\u7528\u3057\u3066\u3044\u307e\u3059\u3002<\/p>\n\n\n\n<h3 class=\"wp-block-heading\">4. \u78ba\u8a8d<\/h3>\n\n\n\n<p>\u5148\u305a\u4eee\u60f3\u74b0\u5883\u3092\u6709\u52b9\u5316\u3057\u307e\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>$ conda activate rdkit<\/code><\/pre>\n\n\n\n<p>\u305d\u3057\u3066\u4ee5\u4e0b\u306e\u30b3\u30de\u30f3\u30c9\u3092\u5b9f\u884c\u3057\u3066\u7279\u306b\u30a8\u30e9\u30fc\u30e1\u30c3\u30bb\u30fc\u30b8\u304c\u51fa\u306a\u3051\u308c\u3070\u6210\u529f\u3067\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>$ python -c \"import rdkit\"<\/code><\/pre>\n\n\n\n<h2 class=\"wp-block-heading\">RDKit\u7528\u306eCMakeLists.txt<\/h2>\n\n\n\n<p>RDKit\u3092\u5229\u7528\u3057\u305f\u975e\u5e38\u306b\u7c21\u5358\u306aC++\u30d7\u30ed\u30b0\u30e9\u30e0\u3068\u3001\u305d\u308c\u3092\u30d3\u30eb\u30c9\u3059\u308bCMakeLists.txt\u3092\u7528\u610f\u3057\u307e\u3057\u305f\u3002\u4ee5\u4e0b\u306e\u30dc\u30bf\u30f3\u3092\u30af\u30ea\u30c3\u30af\u3057\u3066zip\u30d5\u30a1\u30a4\u30eb\u3092\u30c0\u30a6\u30f3\u30ed\u30fc\u30c9\u3057\u3066\u304f\u3060\u3055\u3044\u3002<\/p>\n\n\n\n<div class=\"wp-block-file\"><a id=\"wp-block-file--media-5f9c9fce-6e3b-4d8b-99e4-49ff0e58fddc\" href=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2023\/01\/programs03.zip\">programs03<\/a><a href=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2023\/01\/programs03.zip\" class=\"wp-block-file__button\" download aria-describedby=\"wp-block-file--media-5f9c9fce-6e3b-4d8b-99e4-49ff0e58fddc\">\u30c0\u30a6\u30f3\u30ed\u30fc\u30c9<\/a><\/div>\n\n\n\n<p>\u9069\u5f53\u306a\u30c7\u30a3\u30ec\u30af\u30c8\u30ea\u3092\u4f5c\u6210\u3057\u3066zip\u30d5\u30a1\u30a4\u30eb\u3092\u89e3\u51cd\u3059\u308b\u3068\u4ee5\u4e0b\u306e\u8868\u306e\u901a\u308a\u30012\u500b\u306e\u30d5\u30a1\u30a4\u30eb\u304c\u51fa\u3066\u304d\u307e\u3059\u3002<\/p>\n\n\n\n<figure class=\"wp-block-table aligncenter is-style-stripes\"><table><thead><tr><th>\u30d5\u30a1\u30a4\u30eb\u540d<\/th><th>\u8aac\u660e<\/th><\/tr><\/thead><tbody><tr><td>CMakeLists.txt<\/td><td>CMake\u306e\u8a2d\u5b9a\u30d5\u30a1\u30a4\u30eb<\/td><\/tr><tr><td>Test.cpp<\/td><td>C++\u30d7\u30ed\u30b0\u30e9\u30e0<\/td><\/tr><\/tbody><\/table><\/figure>\n\n\n\n<p>\u305d\u3057\u3066CMakeLists.txt\u30d5\u30a1\u30a4\u30eb\u306e\u5185\u5bb9\u306f\u4ee5\u4e0b\u306e\u901a\u308a\u3067\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code> 1 cmake_minimum_required (VERSION 3.0)\n 2 project (test)\n 3 set(CMAKE_VERBOSE_MAKEFILE ON)\n 4 \n 5 # \u30b3\u30f3\u30d1\u30a4\u30e9\u8a2d\u5b9a\n 6 set(CMAKE_C_COMPILER gcc)\n 7 set(CMAKE_CXX_COMPILER g++)\n 8 \n 9 # C++17\u3092\u30b5\u30dd\u30fc\u30c8\u3057\u3066\u3044\u308b\u306a\u3089\u3070\u5229\u7528\u3059\u308b\u3002\n10 include(CheckCXXCompilerFlag)\n11 check_cxx_compiler_flag(\"-std=c++17\" STD_CXX17)\n12 if(STD_CXX17)\n13   set(CMAKE_CXX_FLAGS \"-std=c++17 ${CMAKE_CXX_FLAGS}\") \n14 else()\n15   message(WARNING \"The compiler ${CMAKE_CXX_COMPILER} has no C++17 support.\")\n16 endif()\n17 \n18 # RDkit\n19 set(RDKit_DIR $ENV{HOME}\/miniconda3\/envs\/rdkit)\n20 if(RDKit_DIR)\n21   find_path(RDKit_INCLUDE_DIR NAMES GraphMol\/RDKitBase.h PATHS ${RDKit_DIR}\/include PATH_SUFFIXES rdkit NO_DEFAULT_PATH)\n22   find_path(RDKit_LIBRARY_DIR NAMES libRDKitGraphMol.so PATHS ${RDKit_DIR}\/lib NO_DEFAULT_PATH)\n23 else()\n24   find_path(RDKit_INCLUDE_DIR NAMES GraphMol\/RDKitBase.h)\n25   find_path(RDKit_LIBRARY_DIR NAMES libRDKitGraphMol.so)\n26 endif()\n27 if(RDKit_INCLUDE_DIR)\n28   message(STATUS \"RDKit found.\")\n29   link_directories(${RDKit_LIBRARY_DIR})\n30   include(${RDKit_LIBRARY_DIR}\/cmake\/rdkit\/rdkit-config-version.cmake)\n31   set(RDKit_VERSION \"${PACKAGE_VERSION}\")\n32   file(GLOB RDKit_Files ${RDKit_LIBRARY_DIR}\/libRDKit*.so)\n33   foreach(_variable ${RDKit_Files})\n34     string(REGEX REPLACE \"^..*lib(RDKit.+)\\\\.so$\" \"\\\\1\" TMP1 ${_variable})\n35     list(APPEND RDKit_LIBRARIES ${TMP1})\n36   endforeach()\n37 else()\n38   message(FATAL_ERROR \"Could not find RDKit.\")\n39 endif()\n40 include_directories(${RDKit_INCLUDE_DIR})\n41 \n42 # executable\n43 add_executable(Test Test.cpp)\n44 \n45 # link\n46 target_link_libraries(Test ${RDKit_LIBRARIES} python3 boost_python39)<\/code><\/pre>\n\n\n\n<p>\u305d\u308c\u3067\u306f\u89e3\u8aac\u3057\u307e\u3059\u3002\u5148\u305a9\uff5e16\u884c\u76ee\u3067\u3059\u304c\u3001\u3053\u306e\u90e8\u5206\u306fC++17\u3068\u3044\u30462017\u5e74\u306b\u6a19\u6e96\u898f\u683c\u5316\u3055\u308c\u305fC++\u306e\u30d0\u30fc\u30b8\u30e7\u30f3\u304c\u5229\u7528\u3067\u304d\u308b\u30b3\u30f3\u30d1\u30a4\u30e9\u304b\u3069\u3046\u304b\u5224\u5b9a\u3057\u3066\u3044\u307e\u3059\u3002\u3082\u3057\u5229\u7528\u53ef\u80fd\u3067\u3042\u308c\u3070\u300113\u884c\u76ee\u3067&#8221;-std=c++17&#8243;\u3068\u3044\u3046\u30b3\u30f3\u30d1\u30a4\u30eb\u30aa\u30d7\u30b7\u30e7\u30f3\u3092\u8ffd\u52a0\u3057\u307e\u3059\u3002\u3053\u308c\u306fRDKit\u306e\u6700\u65b0\u7248\u306fC++17\u3092\u8981\u6c42\u3059\u308b\u8a2d\u8a08\u306b\u306a\u3063\u3066\u3044\u308b\u305f\u3081\u306e\u63aa\u7f6e\u3067\u3059\u304c\u3001\u500b\u4eba\u7684\u306b\u306f\u7121\u7406\u306b\u65b0\u3057\u3044\u898f\u683c\u306eC++\u3092\u5229\u7528\u3057\u306a\u304f\u3066\u3082\u826f\u3044\u3093\u3058\u3083\u306a\u3044\u304b\u306a\u3041\u3068\u611f\u3058\u307e\u3059\u3002\u3061\u306a\u307f\u306b\u79c1\u306eGCC\u306e\u30d0\u30fc\u30b8\u30e7\u30f3\u306f9.4\u3067\u3059\u3002<\/p>\n\n\n\n<p>\u7d9a\u304f18\uff5e40\u884c\u76ee\u304cRDKit\u3092\u691c\u7d22\u3059\u308b\u90e8\u5206\u3067\u3001\u3053\u306e\u30d6\u30ed\u30b0\u306e\u672c\u984c\u90e8\u5206\u3067\u3059\u300219\u884c\u76ee\u3067RDKit\u304c\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3055\u308c\u3066\u3044\u308b\u30c7\u30a3\u30ec\u30af\u30c8\u30ea\u3092\u6307\u5b9a\u3057\u3066\u3044\u307e\u3059\u3002\u3053\u306e\u90e8\u5206\u306f\u74b0\u5883\u306b\u3088\u3063\u3066\u7570\u306a\u308b\u306e\u3067\u3001\u9069\u5207\u306a\u30c7\u30a3\u30ec\u30af\u30c8\u30ea\u3092\u8a18\u8ff0\u3057\u3066\u304f\u3060\u3055\u3044\u3002\u3053\u306e\u4f8b\u3067\u306f\u300cMiniconda\u3067rdkit\u3068\u3044\u3046\u4eee\u60f3\u74b0\u5883\u3067RDKit\u3092\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3057\u305f\u5834\u5408\u300d\u306e\u30c7\u30a3\u30ec\u30af\u30c8\u30ea\u3068\u306a\u308a\u307e\u3059\u300220\uff5e26\u884c\u76ee\u3067\u30a4\u30f3\u30af\u30eb\u30fc\u30c9\u30d1\u30b9\u3068\u30e9\u30a4\u30d6\u30e9\u30ea\u30d1\u30b9\u3092\u53d6\u5f97\u3057\u307e\u3059\u300227\u884c\u76ee\u3067\u306f\u30a4\u30f3\u30af\u30eb\u30fc\u30c9\u30d1\u30b9\u304c\u53d6\u5f97\u51fa\u6765\u305f\u304b\u3069\u3046\u304b\u5224\u5b9a\u3057\u3066\u3044\u307e\u3059\u3002\u53d6\u5f97\u3067\u304d\u3066\u3044\u306a\u3044\u5834\u5408\u306f38\u884c\u76ee\u306b\u98db\u3093\u3067\u30a8\u30e9\u30fc\u7d42\u4e86\u3057\u307e\u3059\u3002<\/p>\n\n\n\n<p>28\uff5e36\u884c\u76ee\u306f\u5c11\u3057\u8907\u96d1\u306a\u3053\u3068\u3092\u3057\u3066\u3044\u307e\u3059\u3002\u5148\u305a\u300129\u884c\u76ee\u3067\u306f\u30ea\u30f3\u30af\u30c7\u30a3\u30ec\u30af\u30c8\u30ea\u3092\u8a2d\u5b9a\u3057\u3066\u3044\u307e\u3059\u3002<br>30\uff5e31\u884c\u76ee\u3067\u306fRDKit\u306e\u30d0\u30fc\u30b8\u30e7\u30f3\u3092\u53d6\u5f97\u3057\u3066\u3044\u307e\u3059\u3002RDKit\u3092\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3059\u308b\u3068&#8221;rdkit-config-version.cmake&#8221;\u3068\u3044\u3046CMake\u7528\u306e\u30e2\u30b8\u30e5\u30fc\u30eb\u30d5\u30a1\u30a4\u30eb\u3082\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3055\u308c\u308b\u306e\u3067\u3001\u305d\u308c\u3092\u30a4\u30f3\u30af\u30eb\u30fc\u30c9\u3059\u308b\u3053\u3068\u306b\u3088\u3063\u3066\u30d0\u30fc\u30b8\u30e7\u30f3\u3092\u53d6\u5f97\u3057\u307e\u3059\u3002\u305d\u3057\u306632\u884c\u76ee\u3067\u306fRDKit\u306b\u95a2\u4fc2\u3059\u308b\u30e9\u30a4\u30d6\u30e9\u30ea\u3092\u5168\u3066\u53d6\u5f97\u3057\u3066\u3044\u307e\u3059\u3002Linux\u306b\u304a\u3051\u308b\u5171\u6709\u30e9\u30a4\u30d6\u30e9\u30ea\u306f\u62e1\u5f35\u5b50\u304cso\u3068\u3044\u3046\u30d5\u30a1\u30a4\u30eb\u306a\u306e\u3067\u3001\u30d5\u30a1\u30a4\u30eb\u540d\u306e\u5148\u982d\u304c&#8221;libRDKit&#8221;\u3067\u3042\u308bso\u30d5\u30a1\u30a4\u30eb\u3092\u5168\u3066\u53d6\u5f97\u3059\u308b\u3053\u3068\u306b\u3057\u3066\u3044\u307e\u3059\u3002\u672c\u6765\u306a\u3089\u5fc5\u8981\u306a\u30e9\u30a4\u30d6\u30e9\u30ea\u3060\u3051\u3092\u30ea\u30f3\u30af\u3059\u3079\u304d\u306a\u306e\u3067\u3059\u304c\u3001RDKit\u306e\u5834\u5408\u306f\u4f55\u304c\u5fc5\u8981\u306a\u30e9\u30a4\u30d6\u30e9\u30ea\u306a\u306e\u304b\u8abf\u3079\u308b\u306e\u304c\u5927\u5909\u9762\u5012\u306a\u306e\u3067\u3001<br>\u5168\u90e8\u30ea\u30f3\u30af\u3059\u308b\u3053\u3068\u306b\u3057\u307e\u3057\u305f\u300233\uff5e36\u884c\u76ee\u3067\u306f\u53d6\u5f97\u3057\u305f\u30e9\u30a4\u30d6\u30e9\u30ea\u306e\u30d5\u30a1\u30a4\u30eb\u540d\u3092\u6b63\u898f\u8868\u73fe\u3092\u5229\u7528\u3057\u3066\u52a0\u5de5\u3057\u3066\u3044\u307e\u3059\u3002\u30b3\u30f3\u30d1\u30a4\u30e9\u306e&#8221;-l&#8221;\u30aa\u30d7\u30b7\u30e7\u30f3\u3067\u30e9\u30a4\u30d6\u30e9\u30ea\u540d\u3092\u6307\u5b9a\u3059\u308b\u5834\u5408\u306f\u3001\u5148\u982d\u306e&#8221;lib&#8221;\u3068\u672b\u5c3e\u306e&#8221;.so&#8221;\u306f\u4e0d\u8981\u306a\u306e\u3067\u3001\u3053\u306e\u69d8\u306a\u52a0\u5de5\u3092\u65bd\u3057\u3066\u3044\u307e\u3059\u3002\u5b9f\u306f\u7121\u7406\u3057\u3066\u3053\u306e\u3088\u3046\u306a\u30d5\u30a1\u30a4\u30eb\u540d\u306e\u52a0\u5de5\u3057\u306a\u304f\u3066\u3082\u3001\u30ea\u30f3\u30ab\u30fc\u306b\u30d5\u30eb\u30d1\u30b9\u3092\u8a18\u8ff0\u3059\u308c\u3070\u6e08\u3080\u8a71\u306a\u306e\u3067\u3059\u304c\u3001CMake\u3067\u6b63\u898f\u8868\u73fe\u3092\u5229\u7528\u3059\u308b\u5834\u5408\u306e\u4f8b\u3092\u793a\u3057\u305f\u304b\u3063\u305f\u306e\u3067\u5165\u308c\u3066\u307f\u307e\u3057\u305f\u3002\u305d\u3057\u306640\u884c\u76ee\u3067\u30a4\u30f3\u30af\u30eb\u30fc\u30c9\u30d1\u30b9\u3092\u8a2d\u5b9a\u3057\u3066\u3044\u307e\u3059\u3002<\/p>\n\n\n\n<p>\u4e0a\u8a18\u306eRDKit\u90e8\u5206\u304c\u5b9f\u884c\u3055\u308c\u308b\u3068\u3001&#8221;RDKit_INCLUDE_DIR&#8221;\u306b\u306f\u30a4\u30f3\u30af\u30eb\u30fc\u30c9\u30d1\u30b9\u304c\u4ee3\u5165\u3055\u308c\u3001&#8221;RDKit_LIBRARIES&#8221;\u306b\u306fRDKit\u306b\u95a2\u3059\u308b\u5168\u3066\u306e\u30e9\u30a4\u30d6\u30e9\u30ea\u304c\u4ee3\u5165\u3055\u308c\u3001&#8221;RDKit_VERSION&#8221;\u306b\u306fRDKit\u306e\u30d0\u30fc\u30b8\u30e7\u30f3\u304c\u4ee3\u5165\u3055\u308c\u307e\u3059\u3002<\/p>\n\n\n\n<p>\u6700\u5f8c\u306b46\u884c\u76ee\u3067target_link_libraries\u30b3\u30de\u30f3\u30c9\u3067\u5fc5\u8981\u306a\u30e9\u30a4\u30d6\u30e9\u30ea\u3092\u5168\u3066\u8a18\u8ff0\u3059\u308b\u306e\u3067\u3059\u304c\u3001RDKit_LIBRARIES\u3060\u3051\u3067\u306a\u304f&#8221;python3&#8243;\u3068&#8221;boost_python39&#8243;\u3082\u8a18\u8ff0\u3059\u308b\u5fc5\u8981\u304c\u3042\u308a\u307e\u3059\u3002\u7279\u306bboost\u306e\u65b9\u306f\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3057\u305fpython\u306e\u30d0\u30fc\u30b8\u30e7\u30f3\u306b\u3088\u3063\u3066\u6570\u5b57\u90e8\u5206\u304c\u5909\u5316\u3059\u308b\u306e\u3067\u6ce8\u610f\u304c\u5fc5\u8981\u3067\u3059\u3002<\/p>\n\n\n\n<h2 class=\"wp-block-heading\">\u30d3\u30eb\u30c9\u3057\u3066\u307f\u308b<\/h2>\n\n\n\n<p>\u305d\u308c\u3067\u306f\u30d3\u30eb\u30c9\u3057\u3066\u307f\u307e\u3057\u3087\u3046\u3002\u4ee5\u4e0b\u306e\u4e00\u9023\u306e\u30b3\u30de\u30f3\u30c9\u3092\u5b9f\u884c\u3057\u307e\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>$ mkdir build\n$ cd build\n$ cmake ..\n$ make<\/code><\/pre>\n\n\n\n<p>\u6700\u5f8c\u306b&#8221;Test&#8221;\u3068\u3044\u3046\u5b9f\u884c\u30d5\u30a1\u30a4\u30eb\u304c\u51fa\u6765\u3066\u3044\u308c\u3070\u6210\u529f\u3067\u3059\u3002\u3053\u306e\u30d7\u30ed\u30b0\u30e9\u30e0\u306f&#8221;Cc1ccccc1&#8243;\u3068\u3044\u3046\u30c8\u30eb\u30a8\u30f3\u306eSMILES\u3092\u5206\u5b50\u3068\u3057\u3066\u8aad\u307f\u8fbc\u3093\u3067\u3001SD\u5f62\u5f0f\u3067\u6a19\u6e96\u51fa\u529b\u3059\u308b\u3068\u3044\u3046\u3082\u306e\u3067\u3059\u3002&#8221;Test&#8221;\u3092\u5b9f\u884c\u3059\u308b\u3068\u4ee5\u4e0b\u306e\u3088\u3046\u306b\u51fa\u529b\u3055\u308c\u308b\u306f\u305a\u3067\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>$ .\/Test \nToluene\n     RDKit          2D\n\n  7  7  0  0  0  0  0  0  0  0999 V2000\n    3.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  1  0\n  2  3  2  0\n  3  4  1  0\n  4  5  2  0\n  5  6  1  0\n  6  7  2  0\n  7  2  1  0\nM  END<\/code><\/pre>\n\n\n\n<p>\u305d\u3082\u305d\u3082RDKit\u306fPython\u304b\u3089\u5229\u7528\u3059\u308b\u3053\u3068\u3092\u60f3\u5b9a\u3057\u3066\u4f5c\u3089\u308c\u3066\u3044\u308b\u305f\u3081\u3001\u3053\u3093\u306a\u306b\u9762\u5012\u306a\u306e\u304b\u3082\u3057\u308c\u307e\u305b\u3093\u3002<\/p>\n","protected":false},"excerpt":{"rendered":"<p>\u306f\u3058\u3081\u306b \u4eca\u56de\u306e\u8a71\u984c\u306fRDKit\u3092\u5229\u7528\u3057\u305fC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306b\u3064\u3044\u3066CMake\u3092\u9069\u7528\u3057\u3088\u3046\u3068\u601d\u3044\u307e\u3059\u3002\u4eca\u307e\u3067CMake\u306b\u3064\u3044\u30662\u56de\u30d6\u30ed\u30b0\u3092\u66f8\u304d\u307e\u3057\u305f\u304c\u3001\u5b9f\u306f\u3053\u306e\u8a71\u3092\u30d6\u30ed\u30b0\u306b\u3057\u305f\u3044\u304b\u3089\u3067\u3057\u305f\u3002RDKit\u3068\u3044\u3046\u30e9\u30a4\u30d6\u30e9\u30ea\u306fOp&#8230;<\/p>\n","protected":false},"author":5,"featured_media":0,"comment_status":"closed","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"footnotes":""},"categories":[19,33,15],"tags":[],"class_list":["post-2365","post","type-post","status-publish","format-standard","hentry","category-linux","category-rdkit","category-15"],"yoast_head":"<!-- This site is optimized with the Yoast SEO plugin v27.6 - https:\/\/yoast.com\/product\/yoast-seo-wordpress\/ -->\n<title>RDKit\u3092\u5229\u7528\u3059\u308bC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306eCMake\u306b\u3088\u308b\u30d3\u30eb\u30c9 - In Silico \u5275\u85ac<\/title>\n<meta name=\"robots\" content=\"index, follow, max-snippet:-1, max-image-preview:large, max-video-preview:-1\" \/>\n<link rel=\"canonical\" href=\"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/\" \/>\n<meta property=\"og:locale\" content=\"ja_JP\" \/>\n<meta property=\"og:type\" content=\"article\" \/>\n<meta property=\"og:title\" content=\"RDKit\u3092\u5229\u7528\u3059\u308bC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306eCMake\u306b\u3088\u308b\u30d3\u30eb\u30c9 - In Silico \u5275\u85ac\" \/>\n<meta property=\"og:description\" content=\"\u306f\u3058\u3081\u306b \u4eca\u56de\u306e\u8a71\u984c\u306fRDKit\u3092\u5229\u7528\u3057\u305fC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306b\u3064\u3044\u3066CMake\u3092\u9069\u7528\u3057\u3088\u3046\u3068\u601d\u3044\u307e\u3059\u3002\u4eca\u307e\u3067CMake\u306b\u3064\u3044\u30662\u56de\u30d6\u30ed\u30b0\u3092\u66f8\u304d\u307e\u3057\u305f\u304c\u3001\u5b9f\u306f\u3053\u306e\u8a71\u3092\u30d6\u30ed\u30b0\u306b\u3057\u305f\u3044\u304b\u3089\u3067\u3057\u305f\u3002RDKit\u3068\u3044\u3046\u30e9\u30a4\u30d6\u30e9\u30ea\u306fOp...\" \/>\n<meta property=\"og:url\" content=\"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/\" \/>\n<meta property=\"og:site_name\" content=\"In Silico \u5275\u85ac\" \/>\n<meta property=\"article:published_time\" content=\"2023-01-06T04:28:56+00:00\" \/>\n<meta property=\"article:modified_time\" content=\"2023-01-06T05:14:29+00:00\" \/>\n<meta name=\"author\" content=\"\u682a\u5f0f\u4f1a\u793e\u30a4\u30f3\u30c6\u30fc\u30b8\u30d8\u30eb\u30b9\u30b1\u30a2 \u91d1\u4e95 \u5343\u91cc\" \/>\n<meta name=\"twitter:card\" content=\"summary_large_image\" \/>\n<meta name=\"twitter:label1\" content=\"\u57f7\u7b46\u8005\" \/>\n\t<meta name=\"twitter:data1\" content=\"\u682a\u5f0f\u4f1a\u793e\u30a4\u30f3\u30c6\u30fc\u30b8\u30d8\u30eb\u30b9\u30b1\u30a2 \u91d1\u4e95 \u5343\u91cc\" \/>\n\t<meta name=\"twitter:label2\" content=\"\u63a8\u5b9a\u8aad\u307f\u53d6\u308a\u6642\u9593\" \/>\n\t<meta name=\"twitter:data2\" content=\"13\u5206\" \/>\n<script type=\"application\/ld+json\" class=\"yoast-schema-graph\">{\"@context\":\"https:\\\/\\\/schema.org\",\"@graph\":[{\"@type\":\"Article\",\"@id\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/2023\\\/01\\\/06\\\/cmake03\\\/#article\",\"isPartOf\":{\"@id\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/2023\\\/01\\\/06\\\/cmake03\\\/\"},\"author\":{\"name\":\"\u682a\u5f0f\u4f1a\u793e\u30a4\u30f3\u30c6\u30fc\u30b8\u30d8\u30eb\u30b9\u30b1\u30a2 \u91d1\u4e95 \u5343\u91cc\",\"@id\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/#\\\/schema\\\/person\\\/5d8c4749b94f5c23a4504848e93d0a26\"},\"headline\":\"RDKit\u3092\u5229\u7528\u3059\u308bC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306eCMake\u306b\u3088\u308b\u30d3\u30eb\u30c9\",\"datePublished\":\"2023-01-06T04:28:56+00:00\",\"dateModified\":\"2023-01-06T05:14:29+00:00\",\"mainEntityOfPage\":{\"@id\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/2023\\\/01\\\/06\\\/cmake03\\\/\"},\"wordCount\":121,\"articleSection\":[\"Linux\u95a2\u9023\",\"RDKit\",\"\u30d7\u30ed\u30b0\u30e9\u30df\u30f3\u30b0\u95a2\u9023\"],\"inLanguage\":\"ja\"},{\"@type\":\"WebPage\",\"@id\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/2023\\\/01\\\/06\\\/cmake03\\\/\",\"url\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/2023\\\/01\\\/06\\\/cmake03\\\/\",\"name\":\"RDKit\u3092\u5229\u7528\u3059\u308bC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306eCMake\u306b\u3088\u308b\u30d3\u30eb\u30c9 - In Silico \u5275\u85ac\",\"isPartOf\":{\"@id\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/#website\"},\"datePublished\":\"2023-01-06T04:28:56+00:00\",\"dateModified\":\"2023-01-06T05:14:29+00:00\",\"author\":{\"@id\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/#\\\/schema\\\/person\\\/5d8c4749b94f5c23a4504848e93d0a26\"},\"breadcrumb\":{\"@id\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/2023\\\/01\\\/06\\\/cmake03\\\/#breadcrumb\"},\"inLanguage\":\"ja\",\"potentialAction\":[{\"@type\":\"ReadAction\",\"target\":[\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/2023\\\/01\\\/06\\\/cmake03\\\/\"]}]},{\"@type\":\"BreadcrumbList\",\"@id\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/2023\\\/01\\\/06\\\/cmake03\\\/#breadcrumb\",\"itemListElement\":[{\"@type\":\"ListItem\",\"position\":1,\"name\":\"\u30db\u30fc\u30e0\",\"item\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/\"},{\"@type\":\"ListItem\",\"position\":2,\"name\":\"RDKit\u3092\u5229\u7528\u3059\u308bC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306eCMake\u306b\u3088\u308b\u30d3\u30eb\u30c9\"}]},{\"@type\":\"WebSite\",\"@id\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/#website\",\"url\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/\",\"name\":\"In Silico \u5275\u85ac\",\"description\":\"\u3053\u306e\u30d6\u30ed\u30b0\u30b5\u30a4\u30c8\u306f\u3001In silico\u5275\u85ac\u306b\u95a2\u9023\u3059\u308b\u7814\u7a76\u8ad6\u6587\u3084\u30bd\u30d5\u30c8\u30a6\u30a7\u30a2\u30fb\u30c4\u30fc\u30eb\u306e\u5229\u7528\u3084\u30d7\u30ed\u30b0\u30e9\u30df\u30f3\u30b0\u306a\u3069\u306b\u3064\u3044\u3066\u3054\u7d39\u4ecb\u3057\u3066\u3044\u307e\u3059\u3002\",\"potentialAction\":[{\"@type\":\"SearchAction\",\"target\":{\"@type\":\"EntryPoint\",\"urlTemplate\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/?s={search_term_string}\"},\"query-input\":{\"@type\":\"PropertyValueSpecification\",\"valueRequired\":true,\"valueName\":\"search_term_string\"}}],\"inLanguage\":\"ja\"},{\"@type\":\"Person\",\"@id\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/#\\\/schema\\\/person\\\/5d8c4749b94f5c23a4504848e93d0a26\",\"name\":\"\u682a\u5f0f\u4f1a\u793e\u30a4\u30f3\u30c6\u30fc\u30b8\u30d8\u30eb\u30b9\u30b1\u30a2 \u91d1\u4e95 \u5343\u91cc\",\"image\":{\"@type\":\"ImageObject\",\"inLanguage\":\"ja\",\"@id\":\"https:\\\/\\\/secure.gravatar.com\\\/avatar\\\/7835f1ec9e03f47023bf198dd11483bfb82c551c80a0e5e6662d744e8b8f2cee?s=96&d=mm&r=g\",\"url\":\"https:\\\/\\\/secure.gravatar.com\\\/avatar\\\/7835f1ec9e03f47023bf198dd11483bfb82c551c80a0e5e6662d744e8b8f2cee?s=96&d=mm&r=g\",\"contentUrl\":\"https:\\\/\\\/secure.gravatar.com\\\/avatar\\\/7835f1ec9e03f47023bf198dd11483bfb82c551c80a0e5e6662d744e8b8f2cee?s=96&d=mm&r=g\",\"caption\":\"\u682a\u5f0f\u4f1a\u793e\u30a4\u30f3\u30c6\u30fc\u30b8\u30d8\u30eb\u30b9\u30b1\u30a2 \u91d1\u4e95 \u5343\u91cc\"},\"url\":\"https:\\\/\\\/www.insilico.jp\\\/blog\\\/author\\\/kanai\\\/\"}]}<\/script>\n<!-- \/ Yoast SEO plugin. -->","yoast_head_json":{"title":"RDKit\u3092\u5229\u7528\u3059\u308bC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306eCMake\u306b\u3088\u308b\u30d3\u30eb\u30c9 - In Silico \u5275\u85ac","robots":{"index":"index","follow":"follow","max-snippet":"max-snippet:-1","max-image-preview":"max-image-preview:large","max-video-preview":"max-video-preview:-1"},"canonical":"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/","og_locale":"ja_JP","og_type":"article","og_title":"RDKit\u3092\u5229\u7528\u3059\u308bC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306eCMake\u306b\u3088\u308b\u30d3\u30eb\u30c9 - In Silico \u5275\u85ac","og_description":"\u306f\u3058\u3081\u306b \u4eca\u56de\u306e\u8a71\u984c\u306fRDKit\u3092\u5229\u7528\u3057\u305fC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306b\u3064\u3044\u3066CMake\u3092\u9069\u7528\u3057\u3088\u3046\u3068\u601d\u3044\u307e\u3059\u3002\u4eca\u307e\u3067CMake\u306b\u3064\u3044\u30662\u56de\u30d6\u30ed\u30b0\u3092\u66f8\u304d\u307e\u3057\u305f\u304c\u3001\u5b9f\u306f\u3053\u306e\u8a71\u3092\u30d6\u30ed\u30b0\u306b\u3057\u305f\u3044\u304b\u3089\u3067\u3057\u305f\u3002RDKit\u3068\u3044\u3046\u30e9\u30a4\u30d6\u30e9\u30ea\u306fOp...","og_url":"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/","og_site_name":"In Silico \u5275\u85ac","article_published_time":"2023-01-06T04:28:56+00:00","article_modified_time":"2023-01-06T05:14:29+00:00","author":"\u682a\u5f0f\u4f1a\u793e\u30a4\u30f3\u30c6\u30fc\u30b8\u30d8\u30eb\u30b9\u30b1\u30a2 \u91d1\u4e95 \u5343\u91cc","twitter_card":"summary_large_image","twitter_misc":{"\u57f7\u7b46\u8005":"\u682a\u5f0f\u4f1a\u793e\u30a4\u30f3\u30c6\u30fc\u30b8\u30d8\u30eb\u30b9\u30b1\u30a2 \u91d1\u4e95 \u5343\u91cc","\u63a8\u5b9a\u8aad\u307f\u53d6\u308a\u6642\u9593":"13\u5206"},"schema":{"@context":"https:\/\/schema.org","@graph":[{"@type":"Article","@id":"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/#article","isPartOf":{"@id":"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/"},"author":{"name":"\u682a\u5f0f\u4f1a\u793e\u30a4\u30f3\u30c6\u30fc\u30b8\u30d8\u30eb\u30b9\u30b1\u30a2 \u91d1\u4e95 \u5343\u91cc","@id":"https:\/\/www.insilico.jp\/blog\/#\/schema\/person\/5d8c4749b94f5c23a4504848e93d0a26"},"headline":"RDKit\u3092\u5229\u7528\u3059\u308bC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306eCMake\u306b\u3088\u308b\u30d3\u30eb\u30c9","datePublished":"2023-01-06T04:28:56+00:00","dateModified":"2023-01-06T05:14:29+00:00","mainEntityOfPage":{"@id":"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/"},"wordCount":121,"articleSection":["Linux\u95a2\u9023","RDKit","\u30d7\u30ed\u30b0\u30e9\u30df\u30f3\u30b0\u95a2\u9023"],"inLanguage":"ja"},{"@type":"WebPage","@id":"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/","url":"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/","name":"RDKit\u3092\u5229\u7528\u3059\u308bC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306eCMake\u306b\u3088\u308b\u30d3\u30eb\u30c9 - In Silico \u5275\u85ac","isPartOf":{"@id":"https:\/\/www.insilico.jp\/blog\/#website"},"datePublished":"2023-01-06T04:28:56+00:00","dateModified":"2023-01-06T05:14:29+00:00","author":{"@id":"https:\/\/www.insilico.jp\/blog\/#\/schema\/person\/5d8c4749b94f5c23a4504848e93d0a26"},"breadcrumb":{"@id":"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/#breadcrumb"},"inLanguage":"ja","potentialAction":[{"@type":"ReadAction","target":["https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/"]}]},{"@type":"BreadcrumbList","@id":"https:\/\/www.insilico.jp\/blog\/2023\/01\/06\/cmake03\/#breadcrumb","itemListElement":[{"@type":"ListItem","position":1,"name":"\u30db\u30fc\u30e0","item":"https:\/\/www.insilico.jp\/blog\/"},{"@type":"ListItem","position":2,"name":"RDKit\u3092\u5229\u7528\u3059\u308bC++\u30d7\u30ed\u30b0\u30e9\u30e0\u306eCMake\u306b\u3088\u308b\u30d3\u30eb\u30c9"}]},{"@type":"WebSite","@id":"https:\/\/www.insilico.jp\/blog\/#website","url":"https:\/\/www.insilico.jp\/blog\/","name":"In Silico \u5275\u85ac","description":"\u3053\u306e\u30d6\u30ed\u30b0\u30b5\u30a4\u30c8\u306f\u3001In silico\u5275\u85ac\u306b\u95a2\u9023\u3059\u308b\u7814\u7a76\u8ad6\u6587\u3084\u30bd\u30d5\u30c8\u30a6\u30a7\u30a2\u30fb\u30c4\u30fc\u30eb\u306e\u5229\u7528\u3084\u30d7\u30ed\u30b0\u30e9\u30df\u30f3\u30b0\u306a\u3069\u306b\u3064\u3044\u3066\u3054\u7d39\u4ecb\u3057\u3066\u3044\u307e\u3059\u3002","potentialAction":[{"@type":"SearchAction","target":{"@type":"EntryPoint","urlTemplate":"https:\/\/www.insilico.jp\/blog\/?s={search_term_string}"},"query-input":{"@type":"PropertyValueSpecification","valueRequired":true,"valueName":"search_term_string"}}],"inLanguage":"ja"},{"@type":"Person","@id":"https:\/\/www.insilico.jp\/blog\/#\/schema\/person\/5d8c4749b94f5c23a4504848e93d0a26","name":"\u682a\u5f0f\u4f1a\u793e\u30a4\u30f3\u30c6\u30fc\u30b8\u30d8\u30eb\u30b9\u30b1\u30a2 \u91d1\u4e95 \u5343\u91cc","image":{"@type":"ImageObject","inLanguage":"ja","@id":"https:\/\/secure.gravatar.com\/avatar\/7835f1ec9e03f47023bf198dd11483bfb82c551c80a0e5e6662d744e8b8f2cee?s=96&d=mm&r=g","url":"https:\/\/secure.gravatar.com\/avatar\/7835f1ec9e03f47023bf198dd11483bfb82c551c80a0e5e6662d744e8b8f2cee?s=96&d=mm&r=g","contentUrl":"https:\/\/secure.gravatar.com\/avatar\/7835f1ec9e03f47023bf198dd11483bfb82c551c80a0e5e6662d744e8b8f2cee?s=96&d=mm&r=g","caption":"\u682a\u5f0f\u4f1a\u793e\u30a4\u30f3\u30c6\u30fc\u30b8\u30d8\u30eb\u30b9\u30b1\u30a2 \u91d1\u4e95 \u5343\u91cc"},"url":"https:\/\/www.insilico.jp\/blog\/author\/kanai\/"}]}},"_links":{"self":[{"href":"https:\/\/www.insilico.jp\/blog\/wp-json\/wp\/v2\/posts\/2365","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/www.insilico.jp\/blog\/wp-json\/wp\/v2\/posts"}],"about":[{"href":"https:\/\/www.insilico.jp\/blog\/wp-json\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"https:\/\/www.insilico.jp\/blog\/wp-json\/wp\/v2\/users\/5"}],"replies":[{"embeddable":true,"href":"https:\/\/www.insilico.jp\/blog\/wp-json\/wp\/v2\/comments?post=2365"}],"version-history":[{"count":8,"href":"https:\/\/www.insilico.jp\/blog\/wp-json\/wp\/v2\/posts\/2365\/revisions"}],"predecessor-version":[{"id":2373,"href":"https:\/\/www.insilico.jp\/blog\/wp-json\/wp\/v2\/posts\/2365\/revisions\/2373"}],"wp:attachment":[{"href":"https:\/\/www.insilico.jp\/blog\/wp-json\/wp\/v2\/media?parent=2365"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"https:\/\/www.insilico.jp\/blog\/wp-json\/wp\/v2\/categories?post=2365"},{"taxonomy":"post_tag","embeddable":true,"href":"https:\/\/www.insilico.jp\/blog\/wp-json\/wp\/v2\/tags?post=2365"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}