[分子对接] 分子对接过程中出现了警告和报错，请教各位老师，这该怎么解决呢

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发表于 Post on 2021-9-27 19:48:01 | 只看该作者 Only view this author |只看大图 View big picture 回帖奖励

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/public1/home/sc50360/software/MPAutoDock/autogrid4: WARNING:  Found an H-bondinn
g atom with three bonded atoms, atom serial number 3884

/public1/home/sc50360/software/MPAutoDock/autodock4-intel-omp-nompi: ERROR: PDBQQ
T ERROR: too many torsions, maximum number of torsions is 32
/public1/home/sc50360/software/MPAutoDock/autodock4-intel-omp-nompi: Aborting...

/public1/home/sc50360/software/MPAutoDock/autodock4-intel-omp-nompi: Unsuccessfuu
l Completion.8.out" 144L, 5178C

Abnormal exit on node 0 for ligand  with rc -1
srun: error: u1905: task 0: Aborted
terminate called after throwing an instance of 'SlaveException144,1       Bot

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[分子对接] 分子对接过程中出现了警告和报错，请教各位老师，这该怎么解决呢

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