You are here

Unsolved

The problem hasn't been solved

Modeling-Using RosettaCM

Category: 
Structure prediction

Hello,

I am new to Rosetta3 and was just suggested to use the RosettaCM protocol rather than minirosetta. I tried to carry out this protocol however, I keep coming to the same error (attached screenshot). I have included my input files as well. I prepared the template PDB as instructuded and inclded necessary target fasta file, and target tempalte alignment file (grishin format). To upload file names were changed to include .txt. Any insight would be helpful.

Justin

Post Situation: 

selecting pivot_residue in Backrub for ensemble generation

Category: 
Docking

Hello,

I need to generate an ensemble of proteins to capture backbone flexibility in docking. I ran relax with thorough flag, but the resultants decoys are not that much different (RMSD ranges fro 0.2 to 0.7). Then I ran Backrub without defining pivot_residue and without resfile. The resultant decoys of Backrub are also similar. Does anyone have suggestions to define pivot_residue? or how can I sample conformational space enough to consider backbone flexibility?

 

Thanks

Post Situation: 

how to know the precedure of solving a actural bio problem? like interface design?

Category: 
Design

hi 

im a doctorial student in the learning process of rosetta scripts

and i was to solve a problem like i got to design a protein complex A0_B0 with known structure and known complex of A1_B1 A2_B2 all Bi are homologs

i need to design a binder A0 that binds to B0

but I just dont know how

and a teacher told me that i needed to manually docking B0 to like a1

and to use fastdesign,fastrelax, to use taskops of layerdesign,limitaromachi2,PruneBuriedUnsats,and filters like BuriedUnsatHbonds

Post Situation: 

Bug Report - Encoding issue

Category: 
Design

I had to do a hard shutdown of a workstation while remodel was running (mpiserialization, openmpi) and when it booted up, i ran remodel again. It had no issues running but checkpoint.txt has a different encoding now like this:

I have no idea why or how, but i purged and reinstalled gedit and it stays the same. I also tried vim and it doesnt display the checkpoint number properly either. It doesn't bother me at the moment, but might be worth checking out why it happens.

Post Situation: 

Pages