1) Generation of 1000 candidates via Boltzgen (length 100-140) 2) Selection of first 30 best candidate binders 3) ranking accordingly to the largest Buried Solvent Accessibility upon binding (DASA)…
Description
Generation of 1000 candidates via Boltzgen (length 100-140)
Selection of first 30 best candidate binders
ranking accordingly to the largest Buried Solvent Accessibility upon binding (DASA)
Performing mutagenesis using BeAtMuSiC. Here we use the symmetric version
Selecting the mutation that increase the binding affinity more than -0.6
Insert all mutations independently on possible epistatic effects