Currently, I am working in CHARMM for setting up simulations and I come across a lot of different errors. Slowly though I am forgetting them and I need to write down how I got passed them all. I hope whatever I face no one else has to encounter or at least minimize confusions.
Error
***** LEVEL -1 WARNING FROM <RDCMND> *****
***** Command line too long: truncated.
Here is the stack trace when receiving this error. What this error is saying that a line using the CHARMM command is over a max line width installed by CHARMM. I have found that this is usually around the pep8 standard for python ~79 characters.
What’s going on is there is an offending line in one of the files I am reading in. If I look higher up on the stacktrace:
VOPEN> Attempting to open::1.1.crd::
OPNLGU> Unit 10 opened for READONLY access to 1.1.crd
It looks like the last thing it did was try to read in a coordinate file:
* GENERATED BY MY SOFTWARE
* COODIRNATE FILE TO RUN CHARMM INTERACTION
* CREATED BY AUTHORS: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
*
23 EXT
It looks like there is a comment with a line that is too long and over the above limit with the repeated AAAAAAAAAAAA
. By changing that line length into a reasonable length fixes the issue.
* GENERATED BY MY SOFTWARE
* COODIRNATE FILE TO RUN CHARMM INTERACTION
* CREATED BY AUTHORS: AAAAAAAAAAAAAAAAAAAAAAAAA
*
23 EXT
This stacktrace means something that is over the length when reading in the file. When you see this stacktrace:
- Look over the last file read
- Look inside that file and check if any lines are within the 79 characters.