标题: 使用gmx_MMPBSA出现The atom 5127 in the complex index is not found in the topo... [打印本页] 作者Author: YuniJ 时间: 2024-4-13 14:53 标题: 使用gmx_MMPBSA出现The atom 5127 in the complex index is not found in the topo... 如题所示，使用gmx_MMPBSA计算蛋白质和小分子的结合自由能时，出现了The atom 5127 in the complex index is not found in the topology file. Please check that the files are consistent.错误，请问该怎么解决呢？作者Author: 那年冬天风在吹 时间: 2025-2-28 13:21
请问你解决了吗？