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Description
autodock_gpu_128wi -M 1ac8_protein.maps.fld -L 1ac8_ligand.pdbqt
To Reproduce
example file , in inputs 1ac8 ,
utodock_gpu_128wi -M 1ac8_protein.maps.fld -L 1ac8_ligand.pdbqt
ERROR
AutoDock-GPU version: v1.6-7-ga46ab564d2ac5f1a1523f65239b43505a1c29364
Running 1 docking calculation
Cuda device: Quadro M520
Available memory on device: 1967 MB (total: 1995 MB)
CUDA Setup time 0.068153s
(Thread 1 is setting up Job #1)
Error: HETATM or ATOM line is too short.
Error in parse_liganddata, stopped job.
Error in setup of Job #1
Run time of entire job set (1 file): 0.155 sec
Processing time: 0.000 sec
The job was not successful.
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