An error was encountered while processing the LAMMPS trajectory file.

[jzh-w]

Dear ReacNetGenerator developers：
When I was using ReacNetGenerator to analyze the trajectory files generated by LAMMPS, I encountered an error indicating that there was a problem with the dump file format. However, after checking the dump file, I found that the information of id type x y z is indeed present. Therefore, I am not quite sure what went wrong.The following two images are the screenshots of the error message and the dump file, respectively.

[njzjz]

Hi @jzh-w, could you share the trajectory?

[jzh-w]

Hello！This file is very large, 934 MB, and I was unable to upload it successfully. I will try splitting it into several smaller samples to send to you

[jzh-w]

Hello, I think I have found the specific reason. At step 4,087,000, line 2205 appears to be inconsistent with the previous format. Could this be the cause?

[njzjz]

Ah, it seems something wrong with LAMMPS.

[njzjz]

If only this step has the problem, consider removing it.

[jzh-w]

Alright, thank you very much! I checked and found that the problem has been occurring since step 4,087,000.