进一步运用在更复杂的分子体系上" + ] + }, + { + "cell_type": "code", + "execution_count": 50, + "metadata": {}, + "outputs": [], + "source": [ + "import os \n", + "#os.environ['KMP_DUPLICATE_LIB_OK']=\"True\"\n", + "os.environ['OMP_NUM_THREADS'] = '4'\...