Protein Engineering

avgfp · Graph CNN

reference_avgfp_gcn_s2_20261104-031059

Metrics

Setmsepearsonrspearmanrr2above_wt_nabove_wt_spearmanrbudget_to_maxhit_rate_at_10mean_at_10max_at_10precision_at_10tie_share_at_10captured_at_10hit_rate_at_50mean_at_50max_at_50precision_at_50tie_share_at_50captured_at_50hit_rate_at_100mean_at_100max_at_100precision_at_100tie_share_at_100captured_at_100hit_rate_at_1pctmean_at_1pctmax_at_1pctprecision_at_1pcttie_share_at_1pctcaptured_at_1pct
test0.10440.95250.86840.9070490.00000.2884229.00000.80003.80893.95800.00000.00000.85310.72003.77713.96310.20000.00000.87960.66003.76263.96310.26000.00000.89710.72223.77383.96310.20370.00000.8800
train0.08840.96010.87470.92144088.00000.26120.10000.80680.12000.83950.09000.85390.17580.8837
validation0.10430.95260.86900.9072466.00000.2539116.00001.00003.81543.88410.00000.00000.85160.72003.76263.93930.14000.00000.87250.65003.75434.03140.21000.00000.89550.71433.75913.93930.12240.00000.8690

Loss per epoch

training validation

Config

name: reference_avgfp_gcn_s2
task: dms
data:
  dataset: avgfp
  encoding: one_hot,aa_index
  split_dir: avgfp/splits/main
  graph_threshold: 7
model:
  name: gcn
  filters:
  - 128
  - 128
  hidden:
  - 100
  dropout: 0.2
train:
  epochs: 300
  batch_size: 32
  learning_rate: 0.0001
  patience: 15
  min_delta: 1.0e-05
  seed: 2