Protein Engineering

avgfp · Graph CNN

reference_avgfp_gcn_s3_20261104-120827

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
test0.10380.95300.86860.9075490.00000.3068168.00000.70003.80493.95800.00000.00000.85010.62003.76293.95800.18000.00000.86850.62003.75783.99230.24000.00000.89320.61113.75893.95800.18520.00000.8683
train0.08770.96060.87550.92204088.00000.26710.00000.77750.06000.82270.09000.84540.19410.8831
validation0.10330.95320.87030.9082466.00000.2572151.00000.90003.81773.93930.00000.00000.85330.72003.76454.03140.14000.00000.87390.63003.75304.03140.22000.00000.89450.71433.76394.03140.14290.00000.8727

Loss per epoch

training validation

Config

name: reference_avgfp_gcn_s3
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: 3