Protein Engineering

avgfp · Graph CNN

reference_avgfp_gcn_s4_20261104-125738

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
test0.08650.96100.87070.9229490.00000.2946150.00000.70003.78323.95800.00000.00000.83420.62003.77173.96310.22000.00000.87530.62003.75603.96480.25000.00000.89170.62963.77053.96310.22220.00000.8775
train0.06830.96940.88120.93924088.00000.27350.10000.80570.06000.82660.08000.84990.22830.8911
validation0.08720.96070.87070.9224466.00000.2566274.00000.90003.82063.93930.00000.00000.85540.70003.75973.93930.14000.00000.87030.60003.73813.93930.17000.00000.88270.71433.76083.93930.14290.00000.8703

Loss per epoch

training validation

Config

name: reference_avgfp_gcn_s4
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: 4