{"id":691,"date":"2019-07-07T21:38:23","date_gmt":"2019-07-07T12:38:23","guid":{"rendered":"https:\/\/www.insilico.jp\/blog\/?p=691"},"modified":"2022-06-29T16:25:51","modified_gmt":"2022-06-29T07:25:51","slug":"openbabel_c_programming_beginner_1","status":"publish","type":"post","link":"https:\/\/www.insilico.jp\/blog\/2019\/07\/07\/openbabel_c_programming_beginner_1\/","title":{"rendered":"OpenBabel\u3067C++\u30d7\u30ed\u30b0\u30e9\u30df\u30f3\u30b0\u3000\u301c\u8d85\u5165\u9580\u3000\u305d\u306e1\u301c"},"content":{"rendered":"\n<h2 class=\"wp-block-heading\">Hello Aspirin<\/h2>\n\n\n\n<p>\u3000OpenBabel\u3092\u7121\u4e8b\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3067\u304d\u307e\u3057\u305f\u304b\uff1f\u4eca\u56de\u306fOpenBabel\u3092\u5229\u7528\u3057\u305f\u8d85\u7c21\u5358\u306aC++\u30d7\u30ed\u30b0\u30e9\u30e0\u3092\u7d39\u4ecb\u3057\u305f\u3044\u3068\u601d\u3044\u307e\u3059\u3002\u5148\u305a\u306f\u4ee5\u4e0b\u306e\u30d7\u30ed\u30b0\u30e9\u30e0\u3092\u30b3\u30f3\u30d1\u30a4\u30eb\u3057\u3066\u307f\u307e\u3057\u3087\u3046\u3002\u3053\u306e\u4f8b\u3067\u306f&#8221;<a href=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/06\/main1.cpp\">main1.cpp<\/a>&#8220;\u3068\u3044\u3046\u30d5\u30a1\u30a4\u30eb\u540d\u3067\u30d7\u30ed\u30b0\u30e9\u30e0\u3092\u4fdd\u5b58\u3057\u307e\u3059\u3002\u3053\u306e\u30d7\u30ed\u30b0\u30e9\u30e0\u306f&#8221;<a href=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/06\/Aspirin.mol\">Aspirin.mol<\/a>&#8220;\u3068\u3044\u3046\u5206\u5b50\u306eMOL\u30d5\u30a1\u30a4\u30eb\u3092\u8aad\u307f\u8fbc\u3093\u3067SMILES\u5f62\u5f0f\u3067\u51fa\u529b\u3059\u308b\u3068\u3044\u3046\u7c21\u5358\u306a\u30d7\u30ed\u30b0\u30e9\u30e0\u3067\u3059\u30022\u500b\u306e\u30d5\u30a1\u30a4\u30eb\u306e\u30ea\u30f3\u30af\u3092\u30af\u30ea\u30c3\u30af\u3057\u3066\u30c0\u30a6\u30f3\u30ed\u30fc\u30c9\u3057\u3066\u4e0b\u3055\u3044\u3002<\/p>\n\n\n\n<!--more-->\n\n\n\n<pre class=\"wp-block-code\"><code>  1 #include &lt;iostream&gt;\n  2 #include &lt;fstream&gt;\n  3 #include &lt;string&gt;\n  4\n  5 #include &lt;openbabel\/mol.h&gt;\n  6 #include &lt;openbabel\/obconversion.h&gt;\n  7\n  8 using namespace std;\n  9 using namespace OpenBabel;\n 10\n 11 int main(int argc, char* argv[]) {\n 12\n 13   ifstream ifs(\"Aspirin.mol\");\n 14\n 15   OBConversion conv;\n 16   conv.SetInFormat(\"MOL\");\n 17   conv.SetOutFormat(\"SMI\");\n 18\n 19   OBMol mol;\n 20   conv.Read(&amp;mol, &amp;ifs);\n 21   conv.Write(&amp;mol, &amp;cout);\n 22 }<\/code><\/pre>\n\n\n\n<p>\/usr\/local\/\u4ee5\u4e0b\u306bOpenBabel\u3092\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3057\u305f\u3068\u3059\u308b\u3068\u3001\u4ee5\u4e0b\u306e\u3088\u3046\u306a\u30b3\u30de\u30f3\u30c9\u3067\u30b3\u30f3\u30d1\u30a4\u30eb\u51fa\u6765\u307e\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>g++ main1.cpp -I\/usr\/local\/include\/openbabel-2.0 -L\/usr\/local\/lib -lopenbabel<\/code><\/pre>\n\n\n\n<p>\u307e\u305f\/home\/username\/app\u306e\u4e0b\u306b\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3057\u305f\u5834\u5408\u306f\/usr\/local\u3092\u7f6e\u304d\u63db\u3048\u308c\u3070\u826f\u3044\u3060\u3051\u3067\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>g++ main1.cpp -I\/home\/username\/app\/include\/openbabel-2.0 -L\/home\/username\/app\/lib -lopenbabel<\/code><\/pre>\n\n\n\n<p>&#8220;a.out&#8221;\u3068\u3044\u3046\u5b9f\u884c\u30d5\u30a1\u30a4\u30eb\u304c\u51fa\u6765\u308b\u306e\u3067\u3001\u5b9f\u884c\u3057\u3066\u307f\u308b\u3068\u4ee5\u4e0b\u306e\u3088\u3046\u306a\u51fa\u529b\u304c\u5f97\u3089\u308c\u307e\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>$ .\/a.out \nc1(c(cccc1)OC(=O)C)C(=O)O\tAspirin<\/code><\/pre>\n\n\n\n<p>\u3053\u308c\u304cOpenBabel\u3092\u5229\u7528\u3057\u305f\u4e00\u756a\u5358\u7d14\u3067\u7c21\u5358\u306a\u30d7\u30ed\u30b0\u30e9\u30e0\u3067\u3059<\/p>\n\n\n\n<h2 class=\"wp-block-heading\">\u7c21\u5358\u306b\u89e3\u8aac<\/h2>\n\n\n\n<p>\u3000\u5148\u305a\u3001OpenBabel\u306e\u30e9\u30a4\u30d6\u30e9\u30ea\u306e\u540d\u524d\u7a7a\u9593\u306f\u305d\u306e\u307e\u307e&#8221;OpenBabel&#8221;\u3067\u3059\u3002\u79c1\u306f\u9762\u5012\u304f\u3055\u304c\u308a\u306a\u306e\u3067\u3001&#8221;using namespace OpenBabel&#8221;\u3068\u3057\u3066\u3057\u307e\u3044\u307e\u3059\u3002\u6b21\u306b\u5206\u5b50\u60c5\u5831\u3092\u6271\u3046\u30af\u30e9\u30b9\u306f&#8221;OBMol&#8221;\u3067\u3059\u3002main1.cpp\u306e19\u884c\u76ee\u306b\u5ba3\u8a00\u3057\u3066\u3044\u307e\u3059\u304c\u3001\u3053\u306e\u30af\u30e9\u30b9\u306e\u30a4\u30f3\u30b9\u30bf\u30f3\u30b9\u304c\u5177\u4f53\u7684\u306a\u5206\u5b50\u69cb\u9020\uff08\u3053\u306e\u4f8b\u3067\u306fAspirin\u306b\u306a\u308a\u307e\u3059\uff09\u3068\u3044\u3046\u3053\u3068\u306b\u306a\u308a\u3001OpenBabel\u3092\u5229\u7528\u3057\u305f\u30d7\u30ed\u30b0\u30e9\u30e0\u3067\u306f\u3053\u306e\u30af\u30e9\u30b9\u3092\u8272\u3005\u5f04\u308b\u308f\u3051\u3067\u3059\u3002<\/p>\n\n\n\n<p>\u3000\u5206\u5b50\u69cb\u9020\u30d5\u30a1\u30a4\u30eb\u306a\u3069\u306e\u8aad\u307f\u66f8\u304d\u3084\u30d5\u30a9\u30fc\u30de\u30c3\u30c8\u5909\u63db\u306f&#8221;OBConversion&#8221;\u3068\u3044\u3046\u30af\u30e9\u30b9\u3092\u4f7f\u3063\u3066\u884c\u3044\u307e\u3059\u3002\u3053\u306e\u30d7\u30ed\u30b0\u30e9\u30e0\u306e\u4f8b\u3067\u306fMOL\u30d5\u30a1\u30a4\u30eb\u3092\u8aad\u307f\u8fbc\u3093\u3067\u3001SMILES\u306b\u5909\u63db\u3057\u3066\u304b\u3089\u6a19\u6e96\u51fa\u529b\u3057\u3066\u3044\u307e\u3059\u304c\u3001\u53d6\u308a\u6271\u3044\u305f\u3044\u5206\u5b50\u30d5\u30a9\u30fc\u30de\u30c3\u30c8\u306f16, 17\u884c\u76ee\u3067\u5165\u529b\u3068\u51fa\u529b\u306e\u5206\u5b50\u30d5\u30a9\u30fc\u30de\u30c3\u30c8\u3092\u6307\u5b9a\u3067\u304d\u307e\u3059\u3002\u3053\u306e\u4f8b\u3067\u306fSMILES\u3092&#8221;SMI&#8221;\u3068\u8a18\u8ff0\u3057\u3066\u3044\u307e\u3059\u304c\u3001Canonical SMILES\u306b\u3057\u305f\u3044\u5834\u5408\u306f&#8221;CAN&#8221;\u3068\u3059\u308c\u3070\u826f\u3044\u3067\u3059\u3002OpenBabel\u3067\u53d6\u308a\u6271\u3048\u308b\u30d5\u30a9\u30fc\u30de\u30c3\u30c8\u306f\u3081\u3061\u3083\u3081\u3061\u3083\u591a\u3044\u306e\u3067\u3001\u30de\u30cb\u30e5\u30a2\u30eb\u306a\u3069\u3067\u78ba\u8a8d\u3057\u3066\u307f\u3066\u304f\u3060\u3055\u3044\u3002<\/p>\n\n\n\n<p>\u3000\u30d5\u30a1\u30a4\u30eb\u304b\u3089\u306e\u8aad\u307f\u8fbc\u307f\u306f20\u884c\u76ee\u3067\u884c\u3063\u3066\u304a\u308a\u3001\u6a19\u6e96\u51fa\u529b\u306f21\u884c\u76ee\u3067\u884c\u3063\u3066\u3044\u307e\u3059\u3002OBConversion\u306e\u30e1\u30bd\u30c3\u30c9\u3067\u3042\u308bRead\u3084Write\u306e\u5f15\u6570\u306b\u3001OBMol\u3068stream\u306e\u30dd\u30a4\u30f3\u30bf\u3092\u6307\u5b9a\u3059\u308c\u3070\u826f\u3044\u3060\u3051\u306a\u306e\u3067\u7c21\u5358\u3067\u3059\u3002<\/p>\n\n\n\n<h2 class=\"wp-block-heading\">\u9006\u306bSMILES\u3092\u8aad\u307f\u8fbc\u3080<\/h2>\n\n\n\n<p>\u3000\u3055\u3066\u9006\u306bSMILES\u306e\u30d5\u30a1\u30a4\u30eb\u3092\u8aad\u307f\u8fbc\u3093\u3067\u304b\u3089MOL\u30d5\u30a1\u30a4\u30eb\u3067\u51fa\u529b\u3059\u308b\u30d7\u30ed\u30b0\u30e9\u30e0\u3092\u4f5c\u3063\u3066\u307f\u307e\u3057\u3087\u3046\u3002\u79c1\u304c\u7528\u610f\u3057\u305f&#8221;<a href=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/06\/main2.cpp\">main2.cpp<\/a>&#8220;\u3068&#8221;<a href=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/06\/Aspirin.smi\">Aspirin.smi<\/a>&#8220;\u3092\u30c0\u30a6\u30f3\u30ed\u30fc\u30c9\u3057\u3066\u307f\u3066\u4e0b\u3055\u3044\u3002\u30d7\u30ed\u30b0\u30e9\u30e0\u306e\u5185\u5bb9\u306f\u5148\u7a0b\u306e\u3082\u306e\u3068\u672c\u8cea\u7684\u306b\u306f\u5909\u308f\u3089\u306a\u3044\u306e\u3067\u8aac\u660e\u306f\u7701\u304d\u307e\u3059\u3002\u3061\u306a\u307f\u306bsmi\u30d5\u30a1\u30a4\u30eb\u306e\u66f8\u5f0f\u306f\u30011\u5217\u76ee\u304cSMILES\u6587\u5b57\u5217\u30672\u5217\u76ee\u304c\u5206\u5b50\u540d\u306b\u306a\u308a\u3001\u533a\u5207\u308a\u306f\u30bf\u30d6\u3068\u306a\u308a\u307e\u3059\u3002\u30c0\u30a6\u30f3\u30ed\u30fc\u30c9\u51fa\u6765\u305f\u3089\u30b3\u30f3\u30d1\u30a4\u30eb\u3057\u3066\u5b9f\u884c\u3057\u3066\u307f\u307e\u3057\u3087\u3046\u3002\u4ee5\u4e0b\u306e\u3088\u3046\u306a\u8b66\u544a\u304c\u6a19\u6e96\u30a8\u30e9\u30fc\u51fa\u529b\u3055\u308c\u308b\u306f\u305a\u3067\u3059\u3002\u3042\u304f\u307e\u3067\u3082\u8b66\u544a\u306a\u306e\u3067\u3001\u30d7\u30ed\u30b0\u30e9\u30e0\u306f\u6700\u5f8c\u307e\u3067\u52d5\u4f5c\u3057\u307e\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>==============================\n*** Open Babel Warning  in WriteMolecule\n  No 2D or 3D coordinates exist. Stereochemical information will be stored using an Open Babel extension. To generate 2D or 3D coordinates instead use --gen2D or --gen3D.<\/code><\/pre>\n\n\n\n<p>\u3053\u308c\u306f\u300c2\u6b21\u5143\u304b3\u6b21\u5143\u69cb\u9020\u306e\u5ea7\u6a19\u5024\u304c\u7121\u3044\u3088\u300d\u3068\u3044\u3046\u8b66\u544a\u3067\u3059\u306d\u3002SMILES\u306b\u306f\u5ea7\u6a19\u60c5\u5831\u306f\u7121\u3044\u306e\u3067\u5f53\u305f\u308a\u524d\u3067\u3059\u304c\u3001\u6bce\u56de\u8868\u793a\u3055\u308c\u308b\u3068\u5c11\u3057\u30a6\u30b6\u3044\u3067\u3059\u3088\u306d\u3002\u3053\u306e\u51fa\u529b\u3092\u6d88\u3059\u306b\u306f2\u901a\u308a\u3042\u308a\u30011\u3064\u306f\u5f37\u5236\u7684\u306b\u51fa\u529b\u3055\u305b\u306a\u3044\u65b9\u6cd5\u30682\u3064\u76ee\u306f2\u6b21\u5143\u304b3\u6b21\u5143\u306e\u5ea7\u6a19\u3092\u751f\u6210\u3059\u308b\u65b9\u6cd5\u3067\u3059\u30021\u3064\u76ee\u306e\u5f37\u5236\u7684\u306b\u30ed\u30b0\u306e\u51fa\u529b\u3092\u505c\u6b62\u3059\u308b\u306b\u306f\u4ee5\u4e0b\u306e1\u884c\u3092\u30d7\u30ed\u30b0\u30e9\u30e0\u306e\u6700\u521d\u306e\u65b9\u306b\u8ffd\u52a0\u3059\u308b\u3060\u3051\u3067\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>obErrorLog.StopLogging();                    <\/code><\/pre>\n\n\n\n<p>\u3053\u308c\u306f\u3001\u3042\u307e\u308a\u304a\u52e7\u3081\u3067\u304d\u308b\u65b9\u6cd5\u3067\u306f\u306a\u3044\u3067\u3059\u304c\u3001\u30d4\u30bf\u30c3\u3068\u30a6\u30b6\u3044\u30e1\u30c3\u30bb\u30fc\u30b8\u304c\u6b62\u307e\u308b\u306f\u305a\u3067\u3059\u3002\u6b21\u306b\u5ea7\u6a19\u751f\u6210\u3059\u308b\u65b9\u6cd5\u3067\u3059\u304c\u30013\u6b21\u5143\u5316\u306f\u8272\u3005\u3068\u9762\u5012\u306a\u306e\u3067\u30012\u6b21\u5143\u69cb\u9020\u3092\u751f\u6210\u3059\u308b\u65b9\u6cd5\u3092\u8aac\u660e\u3057\u307e\u3059\u3002\u4ee5\u4e0b\u306e2\u884c\u3092&#8221;conv.Read(&amp;mol, &amp;ifs);&#8221; \u3068&#8221;conv.Write(&amp;mol, &amp;cout);&#8221;\u306e\u9593\u306b\u633f\u5165\u3057\u3066\u307f\u3066\u4e0b\u3055\u3044\u3002\uff08\u30d7\u30ed\u30b0\u30e9\u30e0\u306f&#8221;<a href=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/06\/main3.cpp\">main3.cpp<\/a>&#8220;\u3067\u3059\u3002\uff09<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>  generateDiagram(&amp;mol);\n  mol.SetDimension(2);<\/code><\/pre>\n\n\n\n<p>\u3053\u306e2\u884c\u306e\u547d\u4ee4\u30672\u6b21\u5143\u69cb\u9020\u304c\u751f\u6210\u3055\u308c\u307e\u3059\u3002\u3053\u306e\u547d\u4ee4\u306e\u610f\u5473\u306f\u3001\u5148\u305a1\u884c\u76ee\u30672\u5143\u69cb\u9020\u3092\u751f\u6210\u3057\u3066\u304b\u3089\u30012\u884c\u76ee\u3067\u3053\u306e\u5206\u5b50\u306f2\u6b21\u5143\u69cb\u9020\u3067\u3042\u308b\u3068\u8a2d\u5b9a\u3057\u3066\u3044\u307e\u3059\u3002\u30b3\u30f3\u30d1\u30a4\u30eb\u3057\u3066\u5b9f\u884c\u3059\u308b\u3068\u4ee5\u4e0b\u306e\u3088\u3046\u306aMOL\u5f62\u5f0f\u306e\u51fa\u529b\u304c\u5f97\u3089\u308c\u307e\u3059\u3002\u3061\u306a\u307f\u306bMOL\u5f62\u5f0f\u306b\u95a2\u3059\u308b\u8a73\u3057\u3044\u8cc7\u6599\u306f<a href=\"https:\/\/web.archive.org\/web\/20070630061308\/http:\/\/www.mdl.com\/downloads\/public\/ctfile\/ctfile.pdf\">\u3053\u3061\u3089<\/a>\u304b\u3089\u53c2\u7167\u3067\u304d\u307e\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>Aspirin\n OpenBabel07071912412D\n\n 13 13  0  0  0  0  0  0  0  0999 V2000\n   -0.8660   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.7321   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.7321    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.8660    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.0000    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.0000   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.5981   -0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.4641   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.4641    1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -4.3301   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.8660   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.7321   -2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.0000   -2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  1  6  1  0  0  0  0\n  1  2  2  0  0  0  0\n  1 11  1  0  0  0  0\n  2  3  1  0  0  0  0\n  2  7  1  0  0  0  0\n  3  4  2  0  0  0  0\n  4  5  1  0  0  0  0\n  5  6  2  0  0  0  0\n  7  8  1  0  0  0  0\n  8  9  2  0  0  0  0\n  8 10  1  0  0  0  0\n 11 12  2  0  0  0  0\n 11 13  1  0  0  0  0\nM  END<\/code><\/pre>\n\n\n\n<p>\u5b9f\u306f\u3001OpenBabel\u306e\u30c9\u30ad\u30e5\u30e1\u30f3\u30c8\u306b\u66f8\u304b\u308c\u3066\u3044\u308b2\u6b21\u5143\u69cb\u9020\u306e\u751f\u6210\u65b9\u6cd5\u306f&#8221;gen2D&#8221;\u30aa\u30d7\u30b7\u30e7\u30f3\u3092OBMol\u30af\u30e9\u30b9\u306b\u9069\u7528\u3059\u308b\u3068\u3044\u3046\u3082\u306e\u306a\u306e\u3067\u3059\u304c\u3001\u5c11\u3057\u9762\u5012\u306a\u306e\u3067\u4eca\u56de\u306f\u7c21\u5358\u306a\u65b9\u6cd5\u3092\u7d39\u4ecb\u3057\u307e\u3057\u305f\u3002&#8221;gen2D&#8221;\u30aa\u30d7\u30b7\u30e7\u30f3\u3092\u9069\u7528\u3059\u308b\u65b9\u6cd5\u306b\u3064\u3044\u3066\u306fOpenBabel\u306e\u30c9\u30ad\u30e5\u30e1\u30f3\u30c8\u3092\u53c2\u7167\u3057\u3066\u4e0b\u3055\u3044\u3002<\/p>\n\n\n\n<h2 class=\"wp-block-heading\">\u69cb\u9020\u5f0f\u306e\u78ba\u8a8d<\/h2>\n\n\n\n<p>\u3000\u4e00\u5fdc\u51fa\u529b\u3055\u308c\u305f\u3082\u306e\u304cAspirin\u306e\u69cb\u9020\u304b\u3069\u3046\u304b\u78ba\u8a8d\u3057\u3066\u307f\u307e\u3057\u3087\u3046\u3002\u3068\u308a\u3042\u3048\u305a\u4ee5\u4e0b\u306e\u3088\u3046\u306b\u51fa\u529b\u3092\u30ea\u30c0\u30a4\u30ec\u30af\u30c8\u3057\u3066\u30d5\u30a1\u30a4\u30eb\u306b\u3057\u307e\u3059\u3002\u3053\u3053\u3067\u306f\u30d5\u30a1\u30a4\u30eb\u540d\u306f&#8221;Aspirin2.mol&#8221;\u3068\u3057\u307e\u3059\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>$ .\/aout &gt; Aspirin2.mol<\/code><\/pre>\n\n\n\n<p>\u305d\u3057\u3066\u3001\u69cb\u9020\u306e\u78ba\u8a8d\u306f\u3082\u3061\u308d\u3093\u4ee5\u4e0b\u306e\u30b3\u30de\u30f3\u30c9\u3067\u3059\uff08\u7b11\uff09\u3002<\/p>\n\n\n\n<pre class=\"wp-block-code\"><code>$ obabel Aspirin2.mol -oascii <\/code><\/pre>\n\n\n\n<p>\u3061\u3083\u3093\u3068Aspirin\u306e\u69cb\u9020\u304c\u898b\u3048\u307e\u3057\u305f\u304b\uff1f<\/p>\n","protected":false},"excerpt":{"rendered":"<p>Hello Aspirin \u3000OpenBabel\u3092\u7121\u4e8b\u30a4\u30f3\u30b9\u30c8\u30fc\u30eb\u3067\u304d\u307e\u3057\u305f\u304b\uff1f\u4eca\u56de\u306fOpenBabel\u3092\u5229\u7528\u3057\u305f\u8d85\u7c21\u5358\u306aC++\u30d7\u30ed\u30b0\u30e9\u30e0\u3092\u7d39\u4ecb\u3057\u305f\u3044\u3068\u601d\u3044\u307e\u3059\u3002\u5148\u305a\u306f\u4ee5\u4e0b\u306e\u30d7\u30ed\u30b0\u30e9\u30e0\u3092\u30b3\u30f3\u30d1\u30a4\u30eb\u3057\u3066\u307f\u307e\u3057\u3087\u3046\u3002\u3053\u306e\u4f8b\u3067&#8230;<\/p>\n","protected":false},"author":5,"featured_media":0,"comment_status":"closed","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"footnotes":""},"categories":[32,15],"tags":[76],"class_list":["post-691","post","type-post","status-publish","format-standard","hentry","category-openbabel","category-15","tag-c"],"yoast_head":"<!-- This site is optimized with the Yoast SEO plugin v27.6 - https:\/\/yoast.com\/product\/yoast-seo-wordpress\/ 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