I get the following error messages after running the simulation:

Sorry, there are no Gasteiger parameters available for atom ligandx.ligand:A:lig1:O7

AutoDock Vina ligand docking initiated for 4y00.pdb

Running AutoDock Vina for 4y00.pdb failed; see Reply Log for information

Application stderr

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Parse error on line 102 in the file "ligand.pdbqt": Atom 45 has not been found in this branch

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Application stdout

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