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Metric reference

This table mirrors cofolder.modules.contracts.METRIC_CATALOG, the authoritative registry used to validate public records. A metric appears only when its scope and evidence are applicable. Direction describes optimization semantics, not a universal scientific threshold.

Metric Group Class Type Unit/scale Direction Scope Evidence
confidence_score confidence_metrics confidence float unitless maximize chain, system reference_free
ptm confidence_metrics confidence float unitless maximize chain, system reference_free
iptm confidence_metrics confidence float unitless maximize chain, system reference_free
chains_ptm confidence_metrics confidence float unitless maximize chain, system reference_free
chain_ptm confidence_metrics confidence float unitless maximize chain, system reference_free
sample_ranking_score confidence_metrics confidence float unitless maximize chain, system reference_free
avg_plddt confidence_metrics confidence float unitless maximize chain, system reference_free
ligand_iptm confidence_metrics confidence float unitless maximize system reference_free
protein_iptm confidence_metrics confidence float unitless maximize system reference_free
complex_plddt confidence_metrics confidence float unitless maximize system reference_free
complex_iplddt confidence_metrics confidence float unitless maximize system reference_free
complex_pde confidence_metrics confidence float unitless minimize system reference_free
complex_ipde confidence_metrics confidence float unitless minimize system reference_free
complex_pae confidence_metrics confidence float unitless minimize system reference_free
complex_ipae confidence_metrics confidence float unitless minimize system reference_free
gpde confidence_metrics confidence float unitless minimize chain, system reference_free
disorder confidence_metrics confidence float unitless minimize chain, system reference_free
has_clash confidence_metrics confidence boolean unitless minimize chain, system reference_free
pair_chains_iptm confidence_metrics confidence float unitless maximize chain_pair reference_free
chain_pair_iptm confidence_metrics confidence float unitless maximize chain_pair reference_free
bespoke_iptm confidence_metrics confidence float unitless maximize chain_pair reference_free
affinity_pred_value affinity_metrics affinity float log10(µM) minimize chain reference_free
affinity_probability_binary affinity_metrics binding float unitless maximize chain reference_free
pIC50 affinity_metrics_ext affinity float pIC50 maximize chain reference_free
IC50_M affinity_metrics_ext affinity float M minimize chain reference_free
IC50_uM affinity_metrics_ext affinity float µM minimize chain reference_free
pIC50_kcal_per_mol affinity_metrics_ext affinity float kcal/mol maximize chain reference_free
sasa structure_metrics structural float Ų neutral chain reference_free
sasa_norm_heavy structure_metrics structural float Ų/heavy atom neutral chain reference_free
ifp_distance structure_metrics structural JSON unitless neutral chain reference_free
ifp_distance_features structure_metrics structural JSON unitless neutral chain reference_free
ifp_prolif structure_metrics structural JSON unitless neutral chain reference_free
ifp_prolif_features structure_metrics structural JSON unitless neutral chain reference_free
ifp_prolif_events structure_metrics structural string unitless neutral chain reference_free
ligand_rmsd_ref reproduction_metrics reproduction float Å minimize chain, system reference_structure
protein_rmsd_ref reproduction_metrics reproduction float Å minimize chain, system reference_structure
ligand_rmsd_ref_mean reproduction_metrics reproduction float Å minimize chain, system reference_structure
protein_rmsd_ref_mean reproduction_metrics reproduction float Å minimize chain, system reference_structure
sucos_ref reproduction_metrics reproduction float unitless maximize chain, system reference_structure
sucos_shape_ref reproduction_metrics reproduction float unitless maximize chain, system reference_structure
sucos_feature_ref reproduction_metrics reproduction float unitless maximize chain, system reference_structure
sucos_ref_mean reproduction_metrics reproduction float unitless maximize chain, system reference_structure
ligand_pose_overlap_ref reproduction_metrics reproduction float unitless maximize chain, system reference_structure
pocket_coverage_ref reproduction_metrics reproduction float unitless maximize chain, system reference_structure
pocket_coverage_ref_mean reproduction_metrics reproduction float unitless maximize chain, system reference_structure
pocket_coverage_custom reproduction_metrics reproduction float unitless maximize chain, system custom_pocket
pocket_coverage_custom_mean reproduction_metrics reproduction float unitless maximize chain, system custom_pocket
bias_prot_sim_train bias_metrics training_proximity float percent identity minimize chain, system reference_free
bias_prot_sim_train_max bias_metrics training_proximity float percent identity minimize chain, system reference_free
bias_prot_sim_train_pairwise bias_metrics training_proximity float percent identity minimize chain, system reference_free
bias_prot_sim_train_pairwise_max bias_metrics training_proximity float percent identity minimize chain, system reference_free
bias_lig_sim_train bias_metrics training_proximity float Tanimoto minimize chain, system reference_free
bias_lig_sim_train_max bias_metrics training_proximity float Tanimoto minimize chain, system reference_free
ifp_filter_pass screen_metrics filter boolean unitless neutral compound custom_pocket, reference_structure
ifp_filter_overlap screen_metrics filter float unitless maximize compound custom_pocket, reference_structure
ifp_filter_similarity screen_metrics filter float unitless maximize compound custom_pocket, reference_structure
ifp_filter_threshold screen_metrics filter float unitless neutral compound custom_pocket, reference_structure
ifp_filter_status screen_metrics filter string unitless neutral compound custom_pocket, reference_structure
ifp_filter_reason screen_metrics filter string unitless neutral compound custom_pocket, reference_structure
ifp_filter_reference screen_metrics filter string unitless neutral compound custom_pocket, reference_structure
ifp_filter_similarity_metric screen_metrics filter string unitless neutral compound custom_pocket, reference_structure
ifp_filter_policy screen_metrics filter string unitless neutral compound custom_pocket, reference_structure
ifp_filter_taxonomy screen_metrics filter string unitless neutral compound custom_pocket, reference_structure
ifp_filter_mapping_status screen_metrics filter string unitless neutral compound custom_pocket, reference_structure
ifp_filter_required_interactions screen_metrics filter JSON unitless neutral compound custom_pocket, reference_structure
ifp_filter_missing_interactions screen_metrics filter JSON unitless neutral compound custom_pocket, reference_structure
ifp_filter_mapping_failures screen_metrics filter JSON unitless neutral compound custom_pocket, reference_structure
ifp_cluster_id screen_metrics filter string unitless neutral compound reference_free
ifp_cluster_status screen_metrics filter string unitless neutral compound reference_free
oracle_score oracle_metrics oracle float unitless neutral compound all regimes
oracle_raw_score oracle_metrics oracle float unitless neutral compound all regimes
oracle_gate_adjusted_score oracle_metrics oracle float unitless neutral compound all regimes
struct_rmsd robustness_metrics robustness float Å minimize chain, system reference_free

Availability and missing values

Every metric record has one of computed, missing, unsupported, failed, or not_requested. Only computed records contain a finite value; every other state uses JSON null plus a machine-readable reason when applicable. Confidence, binding likelihood, model-derived affinity, structural agreement, robustness, and training proximity remain distinct diagnostic classes. A direction is not a claim that one metric or threshold is universally valid.