On Wed, Apr 17, 2019, Zhonghua Xia wrote:
>
>I want to use FEW to expediently batch processing ligands. But I got into
>trouble at the very beginning (using the command file leap_am1). The
>problem is no matter which tool I use to convert my ligands’ file to mol2
>format, FEW just can’t recognise it. Even though I use sdf files, it
>can’t recognise it either. The tools I tried are Maestro, Babel and VMD.
It would be great if you could post one of the mol2 files that failed,
plus the exact error message.
...thanks...dac
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Received on Wed Apr 17 2019 - 05:30:02 PDT
