标题: pdb2gmx报错Warning: No residues in chain starting at HEM142 identified as Pro... [打印本页] 作者Author: ZXFroy 时间: 2022-11-16 15:32 标题: pdb2gmx报错Warning: No residues in chain starting at HEM142 identified as Pro... [新人求助]求助pdb2gmx运行报错，想知道这个残基怎么补充完整
Warning: No residues in chain starting at HEM142 identified as Protein/RNA/DNA.
This makes it impossible to link them into a molecule, which could either be
correct or a catastrophic error. Please check your structure, and add all
necessary residue names to residuetypes.dat if this was not correct.
Problem with chain definition, or missing terminal residues.
This chain does not appear to contain a recognized chain molecule.
If this is incorrect, you can edit residuetypes.dat to modify the behavior.
8 out of 8 lines of specbond.dat converted successfully
Special Atom Distance matrix:
HEM142 HEM142
CAB20 CAC27
HEM142 CAC27 0.799
HEM142 FE43 0.571 0.573