Structure prediction

Hi,

I am using Rosetta 3.8 and trying to use the CartesianMD mover in a RosettaScript. This is what I put in the MOVERS section:

<CartesianMD name="md1test" scorefxn="talaris2014" rattle="true" scorefxn_obj="talaris2014" nstep="1000" temp="300" premin="50" postmin="200" report="20" report_scorecomp="1" selectmode="minobj"  /> 

And after running with some general input options it gave me this error message: 

Error: Element 'CartesianMD', attribute 'scorefxn': The attribute 'scorefxn' is not allowed.

I'm trying to refine a multimer of alpha-beta tubulin structures. I fitted the structures individually in Chimera and saved it as a single file containing all my alpha-beta tubulin monomers. The structure saved this way contain the alternating A and B chains of the different tubulin units (ABABAB).  The refined structures, however, has only two chains A then followed by B. The A chain is the alpha-tubulin chains of all the tubulin units combined, and the B chain is also all the B chains combined (AB, where A = AAAA, and B= BBB).

I have a question regarding parallelizing some of the bash scripts from the refinement and denovo prediction tutorials. They usually rely on GNU parallel to run across many cores, substituting some variable in the script with a number from the GNU parallel run command . I wonder how I can run the same scripts on a server running slurm workload manager, or any other possible multiprocessing strategy using Python.

Hello community,

I have found that I am using Rosetta (C++) only to run Abinitio folding simulations.

Is it possible to isolate just the Abinitio executable from the Rosetta bundle and compile it on its own, rather than keep moving and compiling the entire Rosetta (C++) software?