# ersilia run -i ersilia/test/inputs/compound_singles/csv
^C
Aborted!
# ^C  
# ersilia run -i ersilia/test/inputs/compound_singles.csv
{
    "input": {
        "key": "LUHMMHZLDLBAKX-UHFFFAOYSA-N",
        "input": "CC1C2C(CC3(C=CC(=O)C(=C3C2OC1=O)C)C)O",
        "text": "CC1C2C(CC3(C=CC(=O)C(=C3C2OC1=O)C)C)O"
    },
    "output": {
        "probability": 1.3380866903389688e-07
    }
}
{
    "input": {
        "key": "QRXWMOHMRWLFEY-UHFFFAOYSA-N",
        "input": "C1=CN=CC=C1C(=O)NN",
        "text": "C1=CN=CC=C1C(=O)NN"
    },
    "output": {
        "probability": 0.9951484799385071
    }
}
{
    "input": {
        "key": "SGOIRFVFHAKUTI-UHFFFAOYSA-N",
        "input": "CC(CN1C=NC2=C(N=CN=C21)N)OCP(=O)(O)O",
        "text": "CC(CN1C=NC2=C(N=CN=C21)N)OCP(=O)(O)O"
    },
    "output": {
        "probability": 5.286324721964775e-06
    }
}
{
    "input": {
        "key": "BSYNRYMUTXBXSQ-UHFFFAOYSA-N",
        "input": "CC(=O)OC1=CC=CC=C1C(=O)O",
        "text": "CC(=O)OC1=CC=CC=C1C(=O)O"
    },
    "output": {
        "probability": 5.431320815318941e-08
    }
}
{
    "input": {
        "key": "HEFNNWSXXWATRW-UHFFFAOYSA-N",
        "input": "CC(C)CC1=CC=C(C=C1)C(C)C(=O)O",
        "text": "CC(C)CC1=CC=C(C=C1)C(C)C(=O)O"
    },
    "output": {
        "probability": 2.0687775759142824e-06
    }
}
{
    "input": {
        "key": "IJCOKJGMVJGKBB-UHFFFAOYSA-N",
        "input": "CC1(OC2C(OC(C2O1)(C#N)C3=CC=C4N3N=CN=C4N)CO)C",
        "text": "CC1(OC2C(OC(C2O1)(C#N)C3=CC=C4N3N=CN=C4N)CO)C"
    },
    "output": {
        "probability": 2.890693849622039e-06
    }
}
{
    "input": {
        "key": "YMNCVRSYJBNGLD-UHFFFAOYSA-N",
        "input": "COC1=CC23CCCN2CCC4=CC5=C(C=C4C3C1O)OCO5",
        "text": "COC1=CC23CCCN2CCC4=CC5=C(C=C4C3C1O)OCO5"
    },
    "output": {
        "probability": 0.9925928711891174
    }
}
#