Warning: 1-4 interaction between 1791 and 1794 at distance 1.010 which is larger than the 1-4 table size 1.000 nm
These are ignored for the rest of the simulation
This usually means your system is exploding,
if not, you should increase table-extension in your mdp file
请问这个错误该怎么改啊, table-extension又是什么意思,要把这个参数加到mdp文件吗?在mdout.mdp中默认的table-extension是1,我要改成多少呢??
另外,如果说是结构的原因,那么原子重叠,键太长这种怎么看出来的,请指点一下,谢谢了