Skip to content

Running RFD3 - partial diffusion format issue #233

@Yuzhe-Chen7221

Description

@Yuzhe-Chen7221

Question 1.RFD1 provided script named design_partialdiffusion_withseq.sh, which showed how to optimize binder against a peptide target. However, there is no similar script in RFD3.

Describe the issue/question
The AF3 prediction output were used as input to partial diffusion by RFdiffusion3. In PDB, the binder is A1-A70 and target is B1-B400. Could you provide standard and detailed json file? For example
{
"GUCY2C_binder3_partial_diffusion": {
"dialect": 2,
"input": "./xxx.pdb",
"partial_t": 10.0,
"contig": "A1-70,/0,B1-B400",
"select_fixed_atoms": "B1-B400",
"select_unfixed_sequence": "A1-70,/0"
}
}

Question 2. Could RFD3 be used for scaffold-guided binder design?

Metadata

Metadata

Assignees

No one assigned

    Labels

    questionFurther information is requested

    Type

    No type

    Projects

    No projects

    Milestone

    No milestone

    Relationships

    None yet

    Development

    No branches or pull requests

    Issue actions