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ersilia-os / eos4avb

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Ersilia CLI is populating header with output from the first input in a CSV #4

Closed DhanshreeA closed 1 year ago

DhanshreeA commented 1 year ago

Since the model is not writing a header in the intermediate csv generated from main.py, the CLI is using the first row to populate the header for the final CSV. This is misleading because the first row corresponds to the output for the first molecule in a CSV. This is likely also causing problems when a CSV with only a single molecule is passed.

Refer: https://github.com/ersilia-os/eos4avb/issues/2#issuecomment-1422158939

DhanshreeA commented 1 year ago

Fixed here: https://github.com/ersilia-os/eos4avb/pull/6