job_name: "structure_prediction"
output_path: ""
checkpoint_path: RFAA_paper_weights.pt
database_params:
  sequencedb: ""
  hhdb: "pdb100_2021Mar03/pdb100_2021Mar03"
  command: make_msa.sh
  num_cpus: 4
  mem: 64
protein_inputs: null
na_inputs: null
sm_inputs: null
covale_inputs:  null
residue_replacement: null

chem_params:
  use_phospate_frames_for_NA: True
  use_cif_ordering_for_trp: True

loader_params:
  n_templ: 4
  MAXLAT: 128
  MAXSEQ: 1024
  MAXCYCLE: 4
  BLACK_HOLE_INIT: False
  seqid: 150.0


legacy_model_param:
  n_extra_block: 4
  n_main_block: 32
  n_ref_block: 4
  n_finetune_block: 0
  d_msa: 256
  d_msa_full: 64
  d_pair: 192
  d_templ: 64
  n_head_msa: 8
  n_head_pair: 6
  n_head_templ: 4
  d_hidden_templ: 64
  p_drop: 0.0
  use_chiral_l1: True
  use_lj_l1: True
  use_atom_frames: True
  recycling_type: "all"
  use_same_chain: True
  lj_lin: 0.75
  SE3_param: 
    num_layers: 1
    num_channels: 32
    num_degrees: 2
    l0_in_features: 64
    l0_out_features: 64
    l1_in_features: 3
    l1_out_features: 2
    num_edge_features: 64
    n_heads: 4
    div: 4
  SE3_ref_param:
    num_layers: 2
    num_channels: 32
    num_degrees: 2
    l0_in_features: 64
    l0_out_features: 64
    l1_in_features: 3
    l1_out_features: 2
    num_edge_features: 64
    n_heads: 4
    div: 4