Hello, dear developers!
I am trying to use constraints in RosettaCM. After having successfully launched the application with cofactor-containing templates and generating many decoys with flying high cofactors, I cannot get use of constraints because Rosetta does not see chain X and obviously exit with “chain_id X does not exist”. I tried to use “TER” between chains in templates .pdb’s placing it between protein and cofactor chains. Also I switched all zero-weighted templates “cst” parameters in XML to “NONE” from “AUTO”. Any advices about how to resolve the issue are appreciated in advance. Many thanks.
core.scoring.constraints.SiteConstraint: (0) read: CA 81 constrain to chain: X func: SIGMOID core.pose.util: (0) [ WARNING ] In get_chain_ids_from_chains(): Pose doesn’t have a PDBInfo object – making a temporary default one. protocols.rosetta_scripts.ParsedProtocol: (0) [ ERROR ] Exception while processing procotol:
File: src/core/pose/chains_util.cc:463 chain_id X does not exist protocols.jd2.JobDistributor: (0) [ ERROR ]
[ERROR] Exception caught by JobDistributor for job S_0001
Edit: SOLVED. Hallelujah! Chain_id X don’t exist, but B do exist.
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