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RosettaCommons / RFdiffusion

Code for running RFdiffusion
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is there a way to design multiple chain's 1 binder in same time? #225

Open frankstanmonster opened 6 months ago

frankstanmonster commented 6 months ago

i tried to do so 17135145771691875663931543253969 17135145900432028121945041938830 but it doesn't work

frankstanmonster commented 6 months ago

i tried to design a binder in the center,but i don't know how to code it right

roccomoretti commented 6 months ago

I believe you need to specify that the various fixed chains are disconnected from each other. I think (but haven't tested) that something like contigmap.contigs=[A1-18/0 B24-228/0 C26-313/0 ... is what you would want.

Alternatively, you can mash them all together like you do, but you would need to have them all be the same chain letter designation. (Hence the "If specifying fragmented receptor in a single block of the contig string, they MUST derive from the same chain" message, where "derive from the same chain" means "have the same PDB chain letter designation".)