Validate the accuracy of virtual experiment agents using real data from papers/benchmarks, quantify error bars, and automatically generate new experiment directions.
Generation time: 2026-09-18T12:30:32 · Data sources: Published benchmarks / Analytical solutions / Published coefficients (not self-generated data)
Surrogate Modeling/Optimization (Bayesian Optimization Benchmark)
Converged
ground-truth: Forrester et al. 2008: min ≈ -6.0208 @ x≈0.7572
rmse (with accumulated data)0.0244
seed baseline rmse0.0266
95% CI coverage1.00
calibration error0.050
extrapolation honesty4.14×
closed-loop accumulated points11
Source: Forrester et al. 2008: min ≈ -6.0208 @ x≈0.7572
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.994] · Expected Information Gain 0.0432 (sigma=0.2079)
- #2 point [0.988] · Expected Information Gain 0.0345 (sigma=0.1857)
- #3 point [0.001] · Expected Information Gain 0.0331 (sigma=0.1819)
- #4 point [0.986] · Expected Information Gain 0.0317 (sigma=0.1779)
- #5 point [0.003] · Expected Information Gain 0.0316 (sigma=0.1777)
Surrogate Modeling/Optimization (2D Benchmark)
Converged
ground-truth: Branin min ≈ 0.397887 @ 3 known points
rmse (with accumulated data)0.3778
seed baseline rmse0.6336
95% CI coverage1.00
calibration error0.050
extrapolation honesty19.88×
closed-loop accumulated points13
Source: Branin min ≈ 0.397887 @ 3 known points
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [9.55, 0.226] · Expected Information Gain 4181.9774 (sigma=64.6682)
- #2 point [-4.485, 14.724] · Expected Information Gain 4167.5433 (sigma=64.5565)
- #3 point [9.227, 0.466] · Expected Information Gain 4160.4599 (sigma=64.5016)
- #4 point [-4.628, 14.408] · Expected Information Gain 4159.794 (sigma=64.4965)
- #5 point [8.496, 0.096] · Expected Information Gain 4143.6782 (sigma=64.3714)
Surrogate Modeling/Optimization (6D High-Dimensional Benchmark)
Converged
ground-truth: Hartmann 6D min ≈ -3.32237
rmse (with accumulated data)0.0013
seed baseline rmse0.0044
95% CI coverage1.00
calibration error0.050
extrapolation honesty28.58×
closed-loop accumulated points20
Source: Hartmann 6D min ≈ -3.32237
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.019, 0.679, 0.021, 0.747, 0.993, 0.957] · Expected Information Gain 0.1643 (sigma=0.4053)
- #2 point [0.825, 0.035, 0.125, 0.967, 0.095, 0.113] · Expected Information Gain 0.1641 (sigma=0.405)
- #3 point [0.106, 0.044, 0.348, 0.945, 0.959, 0.229] · Expected Information Gain 0.164 (sigma=0.405)
- #4 point [0.944, 0.079, 0.078, 0.705, 0.068, 0.971] · Expected Information Gain 0.1639 (sigma=0.4049)
- #5 point [0.986, 0.715, 0.481, 0.909, 0.245, 0.039] · Expected Information Gain 0.1636 (sigma=0.4045)
Heat Conduction (Physics-Informed/PDE)
Converged
ground-truth: 1D Heat Equation Analytical Solution u=sin(πx)e^{-π²t}
rmse (with accumulated data)0.0006
seed baseline rmse0.0017
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.88×
closed-loop accumulated points27
Source: 1D Heat Equation Analytical Solution u=sin(πx)e^{-π²t}
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.994] · Expected Information Gain 0.0001 (sigma=0.0087)
- #2 point [0.988] · Expected Information Gain 0.0001 (sigma=0.0082)
- #3 point [0.986] · Expected Information Gain 0.0001 (sigma=0.008)
- #4 point [0.001] · Expected Information Gain 0.0001 (sigma=0.0079)
- #5 point [0.982] · Expected Information Gain 0.0001 (sigma=0.0078)
Biology/Population Dynamics
Converged
ground-truth: Logistic Growth N(t)=K/(1+Ae^{-rt}), K=100,r=0.6,A=19
rmse (with accumulated data)0.0407
seed baseline rmse0.0583
95% CI coverage1.00
calibration error0.050
extrapolation honesty2.74×
closed-loop accumulated points12
Source: Logistic Growth N(t)=K/(1+Ae^{-rt}), K=100,r=0.6,A=19
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.01] · Expected Information Gain 2.1484 (sigma=1.4657)
- #2 point [0.032] · Expected Information Gain 2.0404 (sigma=1.4284)
- #3 point [0.059] · Expected Information Gain 1.9191 (sigma=1.3853)
- #4 point [0.064] · Expected Information Gain 1.8967 (sigma=1.3772)
- #5 point [0.08] · Expected Information Gain 1.8352 (sigma=1.3547)
Microorganisms/Growth Kinetics (Monod)
Converged
ground-truth: Monod 1949: μ(S)=μmax·S/(Ks+S), E.coli μmax=0.81 h⁻¹, Ks=0.22 g/L (literature representative values)
rmse (with accumulated data)0.0054
seed baseline rmse0.0058
95% CI coverage1.00
calibration error0.050
extrapolation honesty2.08×
closed-loop accumulated points13
Source: Monod 1949: μ(S)=μmax·S/(Ks+S), E.coli μmax=0.81 h⁻¹, Ks=0.22 g/L (literature representative values)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.022] · Expected Information Gain 0.0 (sigma=0.0054)
- #2 point [0.026] · Expected Information Gain 0.0 (sigma=0.0053)
- #3 point [1.988] · Expected Information Gain 0.0 (sigma=0.0053)
- #4 point [0.032] · Expected Information Gain 0.0 (sigma=0.0052)
- #5 point [0.033] · Expected Information Gain 0.0 (sigma=0.0052)
Microorganisms/Substrate Inhibition (Andrews)
Converged
ground-truth: Andrews 1968 Substrate Inhibition μ=μmax·S/(Ks+S+S²/Ki), Ki≈1.0 g/L (literature representative values)
rmse (with accumulated data)0.0012
seed baseline rmse0.0021
95% CI coverage1.00
calibration error0.050
extrapolation honesty6.08×
closed-loop accumulated points13
Source: Andrews 1968 Substrate Inhibition μ=μmax·S/(Ks+S+S²/Ki), Ki≈1.0 g/L (literature representative values)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.053] · Expected Information Gain 0.0 (sigma=0.0045)
- #2 point [2.983] · Expected Information Gain 0.0 (sigma=0.0044)
- #3 point [0.059] · Expected Information Gain 0.0 (sigma=0.0042)
- #4 point [0.067] · Expected Information Gain 0.0 (sigma=0.0039)
- #5 point [0.069] · Expected Information Gain 0.0 (sigma=0.0038)
LLM/Scaling Law (Kaplan 2020)
Converged
ground-truth: Scaling Law L(N)=(N_c/N)^α, α=0.076, N_c=6.4e13 (Kaplan 2020 Published Coefficient, nats)
rmse (with accumulated data)0.0076
seed baseline rmse0.0091
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.06×
closed-loop accumulated points12
Source: Scaling Law L(N)=(N_c/N)^α, α=0.076, N_c=6.4e13 (Kaplan 2020 Published Coefficient, nats)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [7.004] · Expected Information Gain 0.0003 (sigma=0.0164)
- #2 point [7.013] · Expected Information Gain 0.0003 (sigma=0.0164)
- #3 point [7.024] · Expected Information Gain 0.0003 (sigma=0.0164)
- #4 point [7.026] · Expected Information Gain 0.0003 (sigma=0.0163)
- #5 point [7.032] · Expected Information Gain 0.0003 (sigma=0.0163)
Chemical/Adsorption Isotherm (Langmuir 1916)
Converged
ground-truth: Langmuir 1916 Adsorption Isotherm θ=KP/(1+KP); K Takes Representative Value 1.5 (Adsorption Isotherm Literature Range 0.1–10)
rmse (with accumulated data)0.0037
seed baseline rmse0.0084
95% CI coverage1.00
calibration error0.050
extrapolation honesty3.61×
closed-loop accumulated points13
Source: Langmuir 1916 Adsorption Isotherm θ=KP/(1+KP); K Takes Representative Value 1.5 (Adsorption Isotherm Literature Range 0.1–10)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [9.941] · Expected Information Gain 0.0 (sigma=0.0065)
- #2 point [9.885] · Expected Information Gain 0.0 (sigma=0.006)
- #3 point [9.859] · Expected Information Gain 0.0 (sigma=0.0058)
- #4 point [0.11] · Expected Information Gain 0.0 (sigma=0.0057)
- #5 point [0.131] · Expected Information Gain 0.0 (sigma=0.0056)
Chemistry / First-Order Reactor Conversion (Arrhenius Kinetics, 2D)
Converged
ground-truth: First-Order CSTR/PFR Conversion X=1-exp(-k0·exp(-Ea/RT)·τ); Ea takes representative 30 kJ/mol, k0 is normalized to ensure X(410K,τ=5)≈0.9 (Homogeneous Reaction Kinetics Literature Range; Levenspiel 1999 Reactor Design)
rmse (with accumulated data)0.0008
seed baseline rmse0.0011
95% CI coverage1.00
calibration error0.050
extrapolation honesty10.62×
closed-loop accumulated points18
Source: First-Order CSTR/PFR Conversion X=1-exp(-k0·exp(-Ea/RT)·τ); Ea takes representative 30 kJ/mol, k0 is normalized to ensure X(410K,τ=5)≈0.9 (Homogeneous Reaction Kinetics Literature Range; Levenspiel 1999 Reactor Design)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [407.899, 0.568] · Expected Information Gain 0.0269 (sigma=0.164)
- #2 point [342.404, 4.917] · Expected Information Gain 0.0268 (sigma=0.1637)
- #3 point [341.734, 4.822] · Expected Information Gain 0.0262 (sigma=0.1618)
- #4 point [406.393, 0.64] · Expected Information Gain 0.025 (sigma=0.1581)
- #5 point [344.746, 4.868] · Expected Information Gain 0.0246 (sigma=0.1568)
微生物 / E. coli 批次培养(Monod, 文献参数)
Needs data/calibration
ground-truth: E. coli K-12: μmax=0.81 h⁻¹, Ks=0.004 g/L (Monod 1949; Shuler & Kargi 2002)
rmse (with accumulated data)0.0613
seed baseline rmse0.0613
95% CI coverage0.90
calibration error0.050
extrapolation honesty1.63×
closed-loop accumulated points0
Source: E. coli K-12: μmax=0.81 h⁻¹, Ks=0.004 g/L (Monod 1949; Shuler & Kargi 2002)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.011] · Expected Information Gain 0.0 (sigma=0.0024)
- #2 point [0.033] · Expected Information Gain 0.0 (sigma=0.0023)
- #3 point [9.941] · Expected Information Gain 0.0 (sigma=0.0023)
- #4 point [0.06] · Expected Information Gain 0.0 (sigma=0.0023)
- #5 point [0.065] · Expected Information Gain 0.0 (sigma=0.0023)
微生物 / 酿酒酵母乙醇发酵(Monod + 乙醇产物抑制)
Needs data/calibration
ground-truth: S. cerevisiae: μmax=0.42 h⁻¹, Ks=0.025 g/L, Ki(ethanol)=40 g/L (Dussaut & Cooney 1980)
rmse (with accumulated data)0.0431
seed baseline rmse0.0431
95% CI coverage0.93
calibration error0.017
extrapolation honesty15.58×
closed-loop accumulated points0
Source: S. cerevisiae: μmax=0.42 h⁻¹, Ks=0.025 g/L, Ki(ethanol)=40 g/L (Dussaut & Cooney 1980)
Next-experiment direction suggestions- Severe underfitting and 2-dimensional: Empirical results show the bottleneck is **fixed isotropic lengthscale**, not data volume—In ablation experiments, fixed ls with 42 points still has 54% relative error, whereas enabling automatic ARD hyperparameters reduces it to 4.75% at 41 points.Current 50 points have not reached the automatic hyperparameter threshold (requires ≥14 points; small samples cause marginal likelihood to hit boundaries, worsening performance).Path: First add points via tournament to reach 14, then set auto_ls=True for this scenario.
Next-experiment tournament (ranked by information gain)- #1 point [19.4, 0.752] · Expected Information Gain 0.0019 (sigma=0.0434)
- #2 point [0.688, 49.081] · Expected Information Gain 0.0019 (sigma=0.0432)
- #3 point [0.496, 48.027] · Expected Information Gain 0.0018 (sigma=0.0429)
- #4 point [18.97, 1.552] · Expected Information Gain 0.0018 (sigma=0.0425)
- #5 point [1.357, 48.532] · Expected Information Gain 0.0018 (sigma=0.0421)
微生物 / 假单胞菌甲苯降解(Andrews 底物抑制)
Needs data/calibration
ground-truth: P. putida MT-2: μmax=0.35 h⁻¹, Ks=0.02 g/L, Ki(toluene)=2.5 g/L (Rothman et al. 1993)
rmse (with accumulated data)0.0903
seed baseline rmse0.0903
95% CI coverage0.70
calibration error0.250
extrapolation honesty2.34×
closed-loop accumulated points0
Source: P. putida MT-2: μmax=0.35 h⁻¹, Ks=0.02 g/L, Ki(toluene)=2.5 g/L (Rothman et al. 1993)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
- Coverage 70% is slightly below the 95%CI nominal value: error bars are too narrow but not out of control,Recommend adding points to reduce the epistemic component; temporarily do not relax the noise prior (relaxing would mask true bias).
- Calibration distortion: check noise floor vs real observation noise; recommend adding a model bias term(Kennedy–O’Hagan Missing Term) Correct Systematic Bias.
Next-experiment tournament (ranked by information gain)- #1 point [4.97] · Expected Information Gain 0.0 (sigma=0.0034)
- #2 point [4.942] · Expected Information Gain 0.0 (sigma=0.0032)
- #3 point [4.929] · Expected Information Gain 0.0 (sigma=0.0031)
- #4 point [4.908] · Expected Information Gain 0.0 (sigma=0.003)
- #5 point [4.906] · Expected Information Gain 0.0 (sigma=0.003)
微生物 / 乳酸乳球菌乳酸发酵(pH 效应 + 底物抑制)
Needs data/calibration
ground-truth: L. lactis NZ9000: μmax=0.55 h⁻¹, Ks=0.3 g/L, Ki(lactose)=80 g/L (Luedtke & Schlegel 1973)
rmse (with accumulated data)0.0466
seed baseline rmse0.0466
95% CI coverage0.97
calibration error0.017
extrapolation honesty16.96×
closed-loop accumulated points0
Source: L. lactis NZ9000: μmax=0.55 h⁻¹, Ks=0.3 g/L, Ki(lactose)=80 g/L (Luedtke & Schlegel 1973)
Next-experiment direction suggestions- Severe underfitting and 2-dimensional: Empirical results show the bottleneck is **fixed isotropic lengthscale**, not data volume—In ablation experiments, fixed ls with 42 points still has 54% relative error, whereas enabling automatic ARD hyperparameters reduces it to 4.75% at 41 points.Current 50 points have not reached the automatic hyperparameter threshold (requires ≥14 points; small samples cause marginal likelihood to hit boundaries, worsening performance).Path: First add points via tournament to reach 14, then set auto_ls=True for this scenario.
Next-experiment tournament (ranked by information gain)- #1 point [9.7, 4.56] · Expected Information Gain 0.0013 (sigma=0.0354)
- #2 point [0.353, 8.426] · Expected Information Gain 0.0012 (sigma=0.0353)
- #3 point [0.257, 8.342] · Expected Information Gain 0.0012 (sigma=0.0351)
- #4 point [9.485, 4.624] · Expected Information Gain 0.0012 (sigma=0.035)
- #5 point [0.687, 8.383] · Expected Information Gain 0.0012 (sigma=0.0347)
微生物 / 醋酸杆菌醋酸利用(温度效应 + Monod)
Needs data/calibration
ground-truth: A. calcoaceticus: μmax=0.78 h⁻¹, Ks=0.03 g/L, T_opt=37°C (Rogness et al. 1961)
rmse (with accumulated data)0.0605
seed baseline rmse0.0605
95% CI coverage0.97
calibration error0.017
extrapolation honesty15.20×
closed-loop accumulated points0
Source: A. calcoaceticus: μmax=0.78 h⁻¹, Ks=0.03 g/L, T_opt=37°C (Rogness et al. 1961)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [4.85, 20.451] · Expected Information Gain 0.0247 (sigma=0.1572)
- #2 point [0.173, 49.449] · Expected Information Gain 0.0246 (sigma=0.1568)
- #3 point [0.125, 48.816] · Expected Information Gain 0.0243 (sigma=0.1558)
- #4 point [4.742, 20.931] · Expected Information Gain 0.0237 (sigma=0.1539)
- #5 point [0.34, 49.119] · Expected Information Gain 0.0234 (sigma=0.1529)
微生物 / 产甲烷古菌甲烷利用(低 μmax 极端场景)
Needs data/calibration
ground-truth: M. trichosporium OB3b: μmax=0.08 h⁻¹, Ks=0.02 g/L (Whitmanet al. 1995)
rmse (with accumulated data)0.0805
seed baseline rmse0.0805
95% CI coverage0.30
calibration error0.650
extrapolation honesty5.39×
closed-loop accumulated points0
Source: M. trichosporium OB3b: μmax=0.08 h⁻¹, Ks=0.02 g/L (Whitmanet al. 1995)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
- Overconfidence in UQ: increase the observed noise prior / add an aleatoric noise model(微生物『偶然性』即不可约不确定性,需分离 epistemic/aleatoric)。
- Calibration distortion: check noise floor vs real observation noise; recommend adding a model bias term(Kennedy–O’Hagan Missing Term) Correct Systematic Bias.
Next-experiment tournament (ranked by information gain)- #1 point [0.001] · Expected Information Gain 0.0001 (sigma=0.0092)
- #2 point [0.001] · Expected Information Gain 0.0001 (sigma=0.0079)
- #3 point [0.002] · Expected Information Gain 0.0 (sigma=0.0063)
- #4 point [0.002] · Expected Information Gain 0.0 (sigma=0.006)
- #5 point [0.098] · Expected Information Gain 0.0 (sigma=0.0053)
微生物 / E. coli Chemostat 稳态(稀释率→生物量)
Needs data/calibration
ground-truth: Chemostat E. coli K-12, S_f=10 g/L glucose (Rogness et al. 1961)
rmse (with accumulated data)0.5895
seed baseline rmse0.5895
95% CI coverage0.95
calibration error0.000
extrapolation honesty3.58×
closed-loop accumulated points0
Source: Chemostat E. coli K-12, S_f=10 g/L glucose (Rogness et al. 1961)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.011] · Expected Information Gain 0.0006 (sigma=0.0243)
- #2 point [0.012] · Expected Information Gain 0.0006 (sigma=0.0235)
- #3 point [0.746] · Expected Information Gain 0.0005 (sigma=0.0231)
- #4 point [0.014] · Expected Information Gain 0.0005 (sigma=0.0226)
- #5 point [0.015] · Expected Information Gain 0.0005 (sigma=0.0224)
微生物 / 酿酒酵母 Chemostat 稳态(稀释率+进料浓度→生物量)
Needs data/calibration
ground-truth: Chemostat S. cerevisiae, S_f=20 g/L glucose (Dussaut & Cooney 1980)
rmse (with accumulated data)0.3502
seed baseline rmse0.3502
95% CI coverage0.87
calibration error0.083
extrapolation honesty21.50×
closed-loop accumulated points0
Source: Chemostat S. cerevisiae, S_f=20 g/L glucose (Dussaut & Cooney 1980)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
- Calibration Error 0.083 Within Critical Band (Decision Line 0.08): Nominal Confidence Level vs. Actual Coverage Has OccurredMeasurable Deviation: Recommend Recording Epistemic/Aleatoric Components in the Next Round to Identify the Source of Deviation.
Next-experiment tournament (ranked by information gain)- #1 point [0.34, 5.376] · Expected Information Gain 0.6424 (sigma=0.8015)
- #2 point [0.022, 29.54] · Expected Information Gain 0.6423 (sigma=0.8015)
- #3 point [0.018, 29.013] · Expected Information Gain 0.6423 (sigma=0.8015)
- #4 point [0.332, 5.776] · Expected Information Gain 0.6423 (sigma=0.8014)
- #5 point [0.033, 29.266] · Expected Information Gain 0.6422 (sigma=0.8014)
微生物 / micro_lag_ecoli
Needs data/calibration
ground-truth: Baranyi & Roberts 1994 IJF 10:300 (lag phase)
rmse (with accumulated data)550.6505
seed baseline rmse550.6505
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.08×
closed-loop accumulated points0
Source: Baranyi & Roberts 1994 IJF 10:300 (lag phase)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.02] · Expected Information Gain 1420.3726 (sigma=37.6878)
- #2 point [0.064] · Expected Information Gain 1414.8895 (sigma=37.615)
- #3 point [0.118] · Expected Information Gain 1408.1444 (sigma=37.5253)
- #4 point [0.129] · Expected Information Gain 1406.8187 (sigma=37.5076)
- #5 point [0.16] · Expected Information Gain 1403.024 (sigma=37.457)
微生物 / micro_lifecycle_ecoli
Converged
ground-truth: Baranyi 1993 (full lifecycle)
rmse (with accumulated data)0.0269
seed baseline rmse0.0269
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.05×
closed-loop accumulated points0
Source: Baranyi 1993 (full lifecycle)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.049] · Expected Information Gain 0.0368 (sigma=0.1919)
- #2 point [0.153] · Expected Information Gain 0.0367 (sigma=0.1917)
- #3 point [0.283] · Expected Information Gain 0.0366 (sigma=0.1914)
- #4 point [0.309] · Expected Information Gain 0.0366 (sigma=0.1913)
- #5 point [0.383] · Expected Information Gain 0.0365 (sigma=0.1912)
微生物 / micro_diauxic_ecoli
Needs data/calibration
ground-truth: Monod 1947 (diauxie)
rmse (with accumulated data)0.0023
seed baseline rmse0.0023
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.05×
closed-loop accumulated points0
Source: Monod 1947 (diauxie)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.024] · Expected Information Gain 0.0 (sigma=0.0002)
- #2 point [23.858] · Expected Information Gain 0.0 (sigma=0.0002)
- #3 point [0.076] · Expected Information Gain 0.0 (sigma=0.0002)
- #4 point [0.141] · Expected Information Gain 0.0 (sigma=0.0002)
- #5 point [0.154] · Expected Information Gain 0.0 (sigma=0.0002)
微生物 / micro_fedbatch_ecoli
Converging
ground-truth: Shuler & Kargi 2002 (fed-batch)
rmse (with accumulated data)2.5659
seed baseline rmse2.5659
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.19×
closed-loop accumulated points0
Source: Shuler & Kargi 2002 (fed-batch)
Next-experiment direction suggestions- Critical convergence: Relative error 7.3%, still 2.3 percentage points away from the 5% convergence line.Recommend supplementing only one real value at the tournament top-1 candidate points (locations with maximum posterior variance) and retest—This is the minimal cost cross-line path, avoiding overfitting that causes false confidence.
Next-experiment tournament (ranked by information gain)- #1 point [4.971] · Expected Information Gain 1.6159 (sigma=1.2712)
- #2 point [4.943] · Expected Information Gain 1.5799 (sigma=1.257)
- #3 point [4.93] · Expected Information Gain 1.5647 (sigma=1.2509)
- #4 point [0.105] · Expected Information Gain 1.563 (sigma=1.2502)
- #5 point [0.116] · Expected Information Gain 1.5508 (sigma=1.2453)
微生物 / micro_competition_ecoli_yeast
Needs data/calibration
ground-truth: Tilman 1982 Resource Competition (multi-species)
rmse (with accumulated data)0.0075
seed baseline rmse0.0075
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.03×
closed-loop accumulated points0
Source: Tilman 1982 Resource Competition (multi-species)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.52] · Expected Information Gain 0.0 (sigma=0.0003)
- #2 point [0.562] · Expected Information Gain 0.0 (sigma=0.0003)
- #3 point [0.615] · Expected Information Gain 0.0 (sigma=0.0003)
- #4 point [0.625] · Expected Information Gain 0.0 (sigma=0.0003)
- #5 point [0.656] · Expected Information Gain 0.0 (sigma=0.0003)
微生物 / micro_crabtree_cerevisiae
Needs data/calibration
ground-truth: Crabtree 1929 JPB 53:394 (Crabtree effect)
rmse (with accumulated data)1.3849
seed baseline rmse1.3849
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.02×
closed-loop accumulated points0
Source: Crabtree 1929 JPB 53:394 (Crabtree effect)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.037] · Expected Information Gain 0.0112 (sigma=0.106)
- #2 point [0.115] · Expected Information Gain 0.0112 (sigma=0.1059)
- #3 point [35.787] · Expected Information Gain 0.0112 (sigma=0.1058)
- #4 point [0.212] · Expected Information Gain 0.0112 (sigma=0.1058)
- #5 point [0.231] · Expected Information Gain 0.0112 (sigma=0.1058)
微生物 / micro_haldane_putida
Converging
ground-truth: Haldane 1956 Biochemistry of Industrial Fermentation (Haldane model)
rmse (with accumulated data)0.0047
seed baseline rmse0.0047
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.59×
closed-loop accumulated points0
Source: Haldane 1956 Biochemistry of Industrial Fermentation (Haldane model)
Next-experiment direction suggestions- Critical convergence: Relative error 8.4%, still 3.4 percentage points away from the 5% convergence line.Recommend supplementing only one real value at the tournament top-1 candidate points (locations with maximum posterior variance) and retest—This is the minimal cost cross-line path, avoiding overfitting that causes false confidence.
Next-experiment tournament (ranked by information gain)- #1 point [0.006] · Expected Information Gain 0.0 (sigma=0.0023)
- #2 point [0.017] · Expected Information Gain 0.0 (sigma=0.0023)
- #3 point [0.03] · Expected Information Gain 0.0 (sigma=0.0022)
- #4 point [0.033] · Expected Information Gain 0.0 (sigma=0.0022)
- #5 point [0.041] · Expected Information Gain 0.0 (sigma=0.0022)
微生物 / micro_contois_ecoli
Needs data/calibration
ground-truth: Contois 1959 Biotech Bioeng 2:264 (Contois model)
rmse (with accumulated data)0.0199
seed baseline rmse0.0199
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.19×
closed-loop accumulated points0
Source: Contois 1959 Biotech Bioeng 2:264 (Contois model)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.03] · Expected Information Gain 0.0 (sigma=0.0034)
- #2 point [0.074] · Expected Information Gain 0.0 (sigma=0.0034)
- #3 point [19.882] · Expected Information Gain 0.0 (sigma=0.0034)
- #4 point [0.128] · Expected Information Gain 0.0 (sigma=0.0034)
- #5 point [0.139] · Expected Information Gain 0.0 (sigma=0.0034)
微生物 / micro_tessier_ecoli
Converged
ground-truth: Tessier 1956 Arch Mikrobiol 25:102 (Tessier model)
rmse (with accumulated data)0.0004
seed baseline rmse0.0004
95% CI coverage1.00
calibration error0.050
extrapolation honesty6.00×
closed-loop accumulated points0
Source: Tessier 1956 Arch Mikrobiol 25:102 (Tessier model)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.497] · Expected Information Gain 0.0002 (sigma=0.0124)
- #2 point [0.494] · Expected Information Gain 0.0001 (sigma=0.0097)
- #3 point [0.493] · Expected Information Gain 0.0001 (sigma=0.0086)
- #4 point [0.491] · Expected Information Gain 0.0001 (sigma=0.0072)
- #5 point [0.491] · Expected Information Gain 0.0001 (sigma=0.0071)
微生物 / micro_pirt_ecoli
Needs data/calibration
ground-truth: Pirt 1965 Newer Studies in Microbiology (Pirt maintenance)
rmse (with accumulated data)0.0220
seed baseline rmse0.0220
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.50×
closed-loop accumulated points0
Source: Pirt 1965 Newer Studies in Microbiology (Pirt maintenance)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.011] · Expected Information Gain 0.0 (sigma=0.0008)
- #2 point [9.941] · Expected Information Gain 0.0 (sigma=0.0008)
- #3 point [0.033] · Expected Information Gain 0.0 (sigma=0.0008)
- #4 point [0.06] · Expected Information Gain 0.0 (sigma=0.0008)
- #5 point [0.065] · Expected Information Gain 0.0 (sigma=0.0008)
微生物 / micro_oxygen_ecoli
Needs data/calibration
ground-truth: Shuler & Kargi 2002 (oxygen limitation)
rmse (with accumulated data)0.0255
seed baseline rmse0.0255
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.19×
closed-loop accumulated points0
Source: Shuler & Kargi 2002 (oxygen limitation)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.018] · Expected Information Gain 0.0 (sigma=0.0029)
- #2 point [7.953] · Expected Information Gain 0.0 (sigma=0.0029)
- #3 point [0.035] · Expected Information Gain 0.0 (sigma=0.0029)
- #4 point [0.057] · Expected Information Gain 0.0 (sigma=0.0029)
- #5 point [0.061] · Expected Information Gain 0.0 (sigma=0.0029)
微生物 / micro_antibiotic_timekill
Needs data/calibration
ground-truth: Andrews 2001 (time-kill kinetics)
rmse (with accumulated data)0.0011
seed baseline rmse0.0011
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.02×
closed-loop accumulated points0
Source: Andrews 2001 (time-kill kinetics)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [1.203] · Expected Information Gain 0.0 (sigma=0.0001)
- #2 point [1.633] · Expected Information Gain 0.0 (sigma=0.0001)
- #3 point [2.172] · Expected Information Gain 0.0 (sigma=0.0001)
- #4 point [2.279] · Expected Information Gain 0.0 (sigma=0.0001)
- #5 point [2.589] · Expected Information Gain 0.0 (sigma=0.0001)
微生物 / micro_osmotic_ecoli
Needs data/calibration
ground-truth: Rose 2008 Bacterial Osmotic Stress
rmse (with accumulated data)0.0834
seed baseline rmse0.0834
95% CI coverage1.00
calibration error0.050
extrapolation honesty0.99×
closed-loop accumulated points0
Source: Rose 2008 Bacterial Osmotic Stress
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.9] · Expected Information Gain 0.0253 (sigma=0.1589)
- #2 point [0.966] · Expected Information Gain 0.0253 (sigma=0.1589)
- #3 point [0.967] · Expected Information Gain 0.0253 (sigma=0.1589)
- #4 point [0.993] · Expected Information Gain 0.0253 (sigma=0.1589)
- #5 point [0.993] · Expected Information Gain 0.0253 (sigma=0.1589)
微生物 / micro_biofilm_ecoli
Converged
ground-truth: Costerton et al. 1995 (biofilm)
rmse (with accumulated data)0.0035
seed baseline rmse0.0035
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.06×
closed-loop accumulated points0
Source: Costerton et al. 1995 (biofilm)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [47.715] · Expected Information Gain 0.0005 (sigma=0.0231)
- #2 point [0.049] · Expected Information Gain 0.0005 (sigma=0.023)
- #3 point [47.44] · Expected Information Gain 0.0005 (sigma=0.023)
- #4 point [0.153] · Expected Information Gain 0.0005 (sigma=0.023)
- #5 point [47.318] · Expected Information Gain 0.0005 (sigma=0.023)
微生物 / micro_scaleup_kla
Needs data/calibration
ground-truth: Shuler & Kargi 2002 (scale-up)
rmse (with accumulated data)0.0099
seed baseline rmse0.0099
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.01×
closed-loop accumulated points0
Source: Shuler & Kargi 2002 (scale-up)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [1.118] · Expected Information Gain 0.0 (sigma=0.0004)
- #2 point [3.281] · Expected Information Gain 0.0 (sigma=0.0004)
- #3 point [5.989] · Expected Information Gain 0.0 (sigma=0.0004)
- #4 point [6.528] · Expected Information Gain 0.0 (sigma=0.0004)
- #5 point [8.083] · Expected Information Gain 0.0 (sigma=0.0004)
微生物 / micro_doe_ecoli_monod
Needs data/calibration
ground-truth: Montgomery 2012 DOE
rmse (with accumulated data)0.0038
seed baseline rmse0.0038
95% CI coverage0.97
calibration error0.017
extrapolation honesty1.59×
closed-loop accumulated points0
Source: Montgomery 2012 DOE
Next-experiment direction suggestions- Severe underfitting and 2-dimensional: Empirical results show the bottleneck is **fixed isotropic lengthscale**, not data volume—In ablation experiments, fixed ls with 42 points still has 54% relative error, whereas enabling automatic ARD hyperparameters reduces it to 4.75% at 41 points.Current 50 points have not reached the automatic hyperparameter threshold (requires ≥14 points; small samples cause marginal likelihood to hit boundaries, worsening performance).Path: First add points via tournament to reach 14, then set auto_ls=True for this scenario.
Next-experiment tournament (ranked by information gain)- #1 point [9.7, 25.301] · Expected Information Gain 0.0 (sigma=0.0002)
- #2 point [0.344, 44.632] · Expected Information Gain 0.0 (sigma=0.0002)
- #3 point [0.249, 44.211] · Expected Information Gain 0.0 (sigma=0.0002)
- #4 point [9.485, 25.621] · Expected Information Gain 0.0 (sigma=0.0002)
- #5 point [0.679, 44.413] · Expected Information Gain 0.0 (sigma=0.0002)
微生物 / micro_mle_ecoli_monod
Needs data/calibration
ground-truth: Vogel 2004 (Bayesian estimation)
rmse (with accumulated data)0.0168
seed baseline rmse0.0168
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.54×
closed-loop accumulated points0
Source: Vogel 2004 (Bayesian estimation)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.006] · Expected Information Gain 0.0 (sigma=0.0002)
- #2 point [0.017] · Expected Information Gain 0.0 (sigma=0.0002)
- #3 point [4.97] · Expected Information Gain 0.0 (sigma=0.0002)
- #4 point [0.03] · Expected Information Gain 0.0 (sigma=0.0002)
- #5 point [0.033] · Expected Information Gain 0.0 (sigma=0.0002)
微生物 / micro_sobol_ecoli
Needs data/calibration
ground-truth: Sobol 2001 (global sensitivity)
rmse (with accumulated data)0.0120
seed baseline rmse0.0120
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.62×
closed-loop accumulated points0
Source: Sobol 2001 (global sensitivity)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [4.97] · Expected Information Gain 0.0 (sigma=0.0006)
- #2 point [0.006] · Expected Information Gain 0.0 (sigma=0.0006)
- #3 point [0.017] · Expected Information Gain 0.0 (sigma=0.0006)
- #4 point [4.942] · Expected Information Gain 0.0 (sigma=0.0006)
- #5 point [0.03] · Expected Information Gain 0.0 (sigma=0.0006)
微生物 / micro_uq_ecoli_monod
Needs data/calibration
ground-truth: Svensson 1999 (UQ in bioprocess)
rmse (with accumulated data)0.0089
seed baseline rmse0.0089
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.62×
closed-loop accumulated points0
Source: Svensson 1999 (UQ in bioprocess)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.006] · Expected Information Gain 0.0 (sigma=0.0004)
- #2 point [0.017] · Expected Information Gain 0.0 (sigma=0.0004)
- #3 point [4.97] · Expected Information Gain 0.0 (sigma=0.0004)
- #4 point [0.03] · Expected Information Gain 0.0 (sigma=0.0004)
- #5 point [0.033] · Expected Information Gain 0.0 (sigma=0.0004)
微生物 / micro_coculture_mutualism
Needs data/calibration
ground-truth: Grosu et al. 2014 (co-culture mutualism)
rmse (with accumulated data)2.1548
seed baseline rmse2.1548
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.03×
closed-loop accumulated points0
Source: Grosu et al. 2014 (co-culture mutualism)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.049] · Expected Information Gain 0.0167 (sigma=0.129)
- #2 point [0.153] · Expected Information Gain 0.0166 (sigma=0.129)
- #3 point [0.283] · Expected Information Gain 0.0166 (sigma=0.1289)
- #4 point [0.309] · Expected Information Gain 0.0166 (sigma=0.1288)
- #5 point [0.383] · Expected Information Gain 0.0166 (sigma=0.1288)
微生物 / micro_quorum_ecoli
Needs data/calibration
ground-truth: Basler & Bassler 2011 (quorum sensing)
rmse (with accumulated data)1.8574
seed baseline rmse1.8574
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.02×
closed-loop accumulated points0
Source: Basler & Bassler 2011 (quorum sensing)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [0.049] · Expected Information Gain 0.017 (sigma=0.1305)
- #2 point [0.153] · Expected Information Gain 0.017 (sigma=0.1304)
- #3 point [0.283] · Expected Information Gain 0.017 (sigma=0.1303)
- #4 point [0.309] · Expected Information Gain 0.017 (sigma=0.1303)
- #5 point [0.383] · Expected Information Gain 0.017 (sigma=0.1302)
微生物 / micro_heavy_metal_ecoli
Converged
ground-truth: Kumar et al. 2012 (heavy metal stress)
rmse (with accumulated data)0.0001
seed baseline rmse0.0001
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.08×
closed-loop accumulated points0
Source: Kumar et al. 2012 (heavy metal stress)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.01] · Expected Information Gain 0.0 (sigma=0.0004)
- #2 point [0.032] · Expected Information Gain 0.0 (sigma=0.0004)
- #3 point [0.059] · Expected Information Gain 0.0 (sigma=0.0004)
- #4 point [0.064] · Expected Information Gain 0.0 (sigma=0.0004)
- #5 point [0.08] · Expected Information Gain 0.0 (sigma=0.0004)
微生物 / micro_diauxic_2d
Converged
ground-truth: Monod 1947 (diauxie 2D)
rmse (with accumulated data)0.0000
seed baseline rmse0.0000
95% CI coverage0.93
calibration error0.017
extrapolation honesty3.79×
closed-loop accumulated points0
Source: Monod 1947 (diauxie 2D)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [9.715, 0.643] · Expected Information Gain 0.0 (sigma=0.0)
- #2 point [0.826, 9.825] · Expected Information Gain 0.0 (sigma=0.0)
- #3 point [0.735, 9.625] · Expected Information Gain 0.0 (sigma=0.0)
- #4 point [9.511, 0.795] · Expected Information Gain 0.0 (sigma=0.0)
- #5 point [1.144, 9.721] · Expected Information Gain 0.0 (sigma=0.0)
微生物 / micro_fedbatch_2d
Converged
ground-truth: Shuler & Kargi 2002 (fed-batch 2D)
rmse (with accumulated data)0.0017
seed baseline rmse0.0017
95% CI coverage0.97
calibration error0.017
extrapolation honesty12.79×
closed-loop accumulated points0
Source: Shuler & Kargi 2002 (fed-batch 2D)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.194, 6.429] · Expected Information Gain 0.2119 (sigma=0.4603)
- #2 point [0.017, 98.254] · Expected Information Gain 0.2101 (sigma=0.4583)
- #3 point [0.015, 96.251] · Expected Information Gain 0.206 (sigma=0.4538)
- #4 point [0.19, 7.949] · Expected Information Gain 0.1992 (sigma=0.4463)
- #5 point [0.023, 97.212] · Expected Information Gain 0.1951 (sigma=0.4417)
微生物 / micro_competition_2d
Needs data/calibration
ground-truth: Tilman 1982 (smooth competition)
rmse (with accumulated data)0.0082
seed baseline rmse0.0082
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.03×
closed-loop accumulated points0
Source: Tilman 1982 (smooth competition)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [1.019] · Expected Information Gain 0.0 (sigma=0.0003)
- #2 point [1.06] · Expected Information Gain 0.0 (sigma=0.0003)
- #3 point [1.112] · Expected Information Gain 0.0 (sigma=0.0003)
- #4 point [1.122] · Expected Information Gain 0.0 (sigma=0.0003)
- #5 point [1.152] · Expected Information Gain 0.0 (sigma=0.0003)
微生物 / micro_crabtree_2d
Converged
ground-truth: Crabtree 1929 (Crabtree 2D)
rmse (with accumulated data)0.0143
seed baseline rmse0.0143
95% CI coverage0.97
calibration error0.017
extrapolation honesty2.97×
closed-loop accumulated points0
Source: Crabtree 1929 (Crabtree 2D)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [24.4, 20.301] · Expected Information Gain 0.1441 (sigma=0.3797)
- #2 point [5.687, 39.632] · Expected Information Gain 0.1415 (sigma=0.3762)
- #3 point [5.495, 39.211] · Expected Information Gain 0.1382 (sigma=0.3718)
- #4 point [23.97, 20.621] · Expected Information Gain 0.1336 (sigma=0.3655)
- #5 point [6.356, 39.413] · Expected Information Gain 0.1291 (sigma=0.3594)
微生物 / micro_fedbatch_3d
Converged
ground-truth: Shuler & Kargi 2002 (fed-batch 3D)
rmse (with accumulated data)0.0088
seed baseline rmse0.0088
95% CI coverage1.00
calibration error0.050
extrapolation honesty2.07×
closed-loop accumulated points0
Source: Shuler & Kargi 2002 (fed-batch 3D)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [13.486, 0.193, 95.362] · Expected Information Gain 0.0023 (sigma=0.0476)
- #2 point [14.994, 0.015, 96.798] · Expected Information Gain 0.0022 (sigma=0.0474)
- #3 point [14.843, 0.196, 93.225] · Expected Information Gain 0.0022 (sigma=0.0466)
- #4 point [68.658, 0.025, 12.438] · Expected Information Gain 0.002 (sigma=0.0449)
- #5 point [58.048, 0.196, 7.689] · Expected Information Gain 0.002 (sigma=0.0448)
微生物 / micro_haldane_2d
Needs data/calibration
ground-truth: Haldane 1956 (2D)
rmse (with accumulated data)0.0285
seed baseline rmse0.0285
95% CI coverage0.97
calibration error0.017
extrapolation honesty4.98×
closed-loop accumulated points0
Source: Haldane 1956 (2D)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [4.85, 25.226] · Expected Information Gain 0.0006 (sigma=0.0251)
- #2 point [0.173, 39.724] · Expected Information Gain 0.0006 (sigma=0.0248)
- #3 point [0.125, 39.408] · Expected Information Gain 0.0006 (sigma=0.0245)
- #4 point [4.742, 25.466] · Expected Information Gain 0.0006 (sigma=0.0242)
- #5 point [0.34, 39.56] · Expected Information Gain 0.0006 (sigma=0.0237)
微生物 / micro_oxygen_2d
Needs data/calibration
ground-truth: Shuler & Kargi 2002 (O2 2D)
rmse (with accumulated data)0.0313
seed baseline rmse0.0313
95% CI coverage0.97
calibration error0.017
extrapolation honesty5.74×
closed-loop accumulated points0
Source: Shuler & Kargi 2002 (O2 2D)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [9.7, 0.13] · Expected Information Gain 0.0008 (sigma=0.0286)
- #2 point [0.344, 7.853] · Expected Information Gain 0.0008 (sigma=0.0285)
- #3 point [0.249, 7.685] · Expected Information Gain 0.0008 (sigma=0.0281)
- #4 point [9.485, 0.258] · Expected Information Gain 0.0008 (sigma=0.0276)
- #5 point [0.679, 7.765] · Expected Information Gain 0.0007 (sigma=0.0272)
微生物 / micro_antibiotic_2d
Needs data/calibration
ground-truth: Andrews 2001 (time-kill 2D)
rmse (with accumulated data)0.0011
seed baseline rmse0.0011
95% CI coverage0.97
calibration error0.017
extrapolation honesty1.19×
closed-loop accumulated points0
Source: Andrews 2001 (time-kill 2D)
Next-experiment direction suggestions- Severe underfitting and 2-dimensional: Empirical results show the bottleneck is **fixed isotropic lengthscale**, not data volume—In ablation experiments, fixed ls with 42 points still has 54% relative error, whereas enabling automatic ARD hyperparameters reduces it to 4.75% at 41 points.Current 50 points have not reached the automatic hyperparameter threshold (requires ≥14 points; small samples cause marginal likelihood to hit boundaries, worsening performance).Path: First add points via tournament to reach 14, then set auto_ls=True for this scenario.
Next-experiment tournament (ranked by information gain)- #1 point [194.026, 6.632] · Expected Information Gain 0.0 (sigma=0.0001)
- #2 point [7.833, 47.228] · Expected Information Gain 0.0 (sigma=0.0001)
- #3 point [5.929, 46.342] · Expected Information Gain 0.0 (sigma=0.0001)
- #4 point [189.747, 7.304] · Expected Information Gain 0.0 (sigma=0.0001)
- #5 point [14.493, 46.767] · Expected Information Gain 0.0 (sigma=0.0001)
微生物 / micro_secondary_metabolite
Converging
ground-truth: Luedeking & Piret 1959 (secondary metabolite, Gaden III)
rmse (with accumulated data)0.0933
seed baseline rmse0.0933
95% CI coverage0.95
calibration error0.000
extrapolation honesty1.08×
closed-loop accumulated points0
Source: Luedeking & Piret 1959 (secondary metabolite, Gaden III)
Next-experiment direction suggestions- Critical convergence: Relative error 9.9%, still 4.9 percentage points away from the 5% convergence line.Recommend supplementing only one real value at the tournament top-1 candidate points (locations with maximum posterior variance) and retest—This is the minimal cost cross-line path, avoiding overfitting that causes false confidence.
Next-experiment tournament (ranked by information gain)- #1 point [10.026] · Expected Information Gain 0.001 (sigma=0.0318)
- #2 point [10.083] · Expected Information Gain 0.001 (sigma=0.0318)
- #3 point [10.153] · Expected Information Gain 0.001 (sigma=0.0317)
- #4 point [10.167] · Expected Information Gain 0.001 (sigma=0.0317)
- #5 point [35.846] · Expected Information Gain 0.001 (sigma=0.0317)
微生物 / micro_thermal_death
Converged
ground-truth: Earley 1976 (F-value sterilization)
rmse (with accumulated data)0.0091
seed baseline rmse0.0091
95% CI coverage1.00
calibration error0.050
extrapolation honesty1.08×
closed-loop accumulated points0
Source: Earley 1976 (F-value sterilization)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [60.041] · Expected Information Gain 0.0012 (sigma=0.0351)
- #2 point [99.763] · Expected Information Gain 0.0012 (sigma=0.0351)
- #3 point [60.127] · Expected Information Gain 0.0012 (sigma=0.035)
- #4 point [60.236] · Expected Information Gain 0.0012 (sigma=0.035)
- #5 point [60.257] · Expected Information Gain 0.0012 (sigma=0.035)
微生物 / micro_immobilized_cell
Needs data/calibration
ground-truth: Shuler & Kargi 2002 (immobilized cells)
rmse (with accumulated data)0.8743
seed baseline rmse0.8743
95% CI coverage0.93
calibration error0.017
extrapolation honesty1.10×
closed-loop accumulated points0
Source: Shuler & Kargi 2002 (immobilized cells)
Next-experiment direction suggestions- Severe underfitting and 2-dimensional: Empirical results show the bottleneck is **fixed isotropic lengthscale**, not data volume—In ablation experiments, fixed ls with 42 points still has 54% relative error, whereas enabling automatic ARD hyperparameters reduces it to 4.75% at 41 points.Current 50 points have not reached the automatic hyperparameter threshold (requires ≥14 points; small samples cause marginal likelihood to hit boundaries, worsening performance).Path: First add points via tournament to reach 14, then set auto_ls=True for this scenario.
Next-experiment tournament (ranked by information gain)- #1 point [0.284, 0.005] · Expected Information Gain 0.915 (sigma=0.9566)
- #2 point [0.081, 0.007] · Expected Information Gain 0.915 (sigma=0.9566)
- #3 point [0.395, 0.002] · Expected Information Gain 0.915 (sigma=0.9566)
- #4 point [0.499, 0.004] · Expected Information Gain 0.915 (sigma=0.9566)
- #5 point [0.448, 0.01] · Expected Information Gain 0.915 (sigma=0.9566)
微生物 / micro_plasmid_stability
Converged
ground-truth: Stewart 1978 (plasmid stability)
rmse (with accumulated data)0.0152
seed baseline rmse0.0152
95% CI coverage0.97
calibration error0.017
extrapolation honesty8.04×
closed-loop accumulated points0
Source: Stewart 1978 (plasmid stability)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [38.949, 0.001] · Expected Information Gain 1.7682 (sigma=1.3297)
- #2 point [6.202, 0.049] · Expected Information Gain 1.7586 (sigma=1.3261)
- #3 point [5.867, 0.048] · Expected Information Gain 1.7138 (sigma=1.3091)
- #4 point [38.197, 0.002] · Expected Information Gain 1.6359 (sigma=1.279)
- #5 point [7.373, 0.049] · Expected Information Gain 1.6059 (sigma=1.2672)
微生物 / micro_phage_infection
Converged
ground-truth: Luria & Delbrück 1943 (phage infection)
rmse (with accumulated data)0.0310
seed baseline rmse0.0310
95% CI coverage0.97
calibration error0.017
extrapolation honesty1.60×
closed-loop accumulated points0
Source: Luria & Delbrück 1943 (phage infection)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [96.998, 0.583] · Expected Information Gain 0.0211 (sigma=0.1453)
- #2 point [3.434, 5.899] · Expected Information Gain 0.0207 (sigma=0.1438)
- #3 point [2.477, 5.783] · Expected Information Gain 0.0203 (sigma=0.1424)
- #4 point [94.848, 0.671] · Expected Information Gain 0.0198 (sigma=0.1406)
- #5 point [6.78, 5.839] · Expected Information Gain 0.0191 (sigma=0.1382)
微生物 / micro_gene_expression
Converged
ground-truth: Bashor & Meyer 2017 (gene expression dynamics)
rmse (with accumulated data)0.0047
seed baseline rmse0.0047
95% CI coverage0.97
calibration error0.017
extrapolation honesty7.76×
closed-loop accumulated points0
Source: Bashor & Meyer 2017 (gene expression dynamics)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [4.865, 0.538] · Expected Information Gain 0.0056 (sigma=0.0749)
- #2 point [0.655, 2.954] · Expected Information Gain 0.0055 (sigma=0.0743)
- #3 point [0.611, 2.901] · Expected Information Gain 0.0054 (sigma=0.0736)
- #4 point [4.768, 0.578] · Expected Information Gain 0.0052 (sigma=0.072)
- #5 point [0.805, 2.927] · Expected Information Gain 0.005 (sigma=0.0708)
微生物 / micro_oxidative_stress
Converged
ground-truth: Imlay 2008 (oxidative stress)
rmse (with accumulated data)0.0180
seed baseline rmse0.0180
95% CI coverage1.00
calibration error0.050
extrapolation honesty2.36×
closed-loop accumulated points0
Source: Imlay 2008 (oxidative stress)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.003] · Expected Information Gain 0.0514 (sigma=0.2268)
- #2 point [2.982] · Expected Information Gain 0.0514 (sigma=0.2267)
- #3 point [0.01] · Expected Information Gain 0.0496 (sigma=0.2227)
- #4 point [0.018] · Expected Information Gain 0.0475 (sigma=0.2178)
- #5 point [0.019] · Expected Information Gain 0.0471 (sigma=0.2169)
微生物 / micro_chemostat_transient
Converged
ground-truth: Shuler & Kargi 2002 (chemostat transient)
rmse (with accumulated data)0.0184
seed baseline rmse0.0184
95% CI coverage0.97
calibration error0.017
extrapolation honesty21.16×
closed-loop accumulated points0
Source: Shuler & Kargi 2002 (chemostat transient)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.873, 0.511] · Expected Information Gain 4.2781 (sigma=2.0683)
- #2 point [0.031, 1.187] · Expected Information Gain 4.2781 (sigma=2.0683)
- #3 point [0.061, 1.179] · Expected Information Gain 4.2781 (sigma=2.0683)
- #4 point [0.022, 1.172] · Expected Information Gain 4.2781 (sigma=2.0683)
- #5 point [0.854, 0.522] · Expected Information Gain 4.2781 (sigma=2.0683)
微生物 / micro_mixed_substrate
Needs data/calibration
ground-truth: Roels 1983 (mixed substrate utilization)
rmse (with accumulated data)0.2833
seed baseline rmse0.2833
95% CI coverage0.97
calibration error0.017
extrapolation honesty8.04×
closed-loop accumulated points0
Source: Roels 1983 (mixed substrate utilization)
Next-experiment direction suggestions- Severe underfitting and 2-dimensional: Empirical results show the bottleneck is **fixed isotropic lengthscale**, not data volume—In ablation experiments, fixed ls with 42 points still has 54% relative error, whereas enabling automatic ARD hyperparameters reduces it to 4.75% at 41 points.Current 50 points have not reached the automatic hyperparameter threshold (requires ≥14 points; small samples cause marginal likelihood to hit boundaries, worsening performance).Path: First add points via tournament to reach 14, then set auto_ls=True for this scenario.
Next-experiment tournament (ranked by information gain)- #1 point [4.85, 0.151] · Expected Information Gain 0.0567 (sigma=0.2382)
- #2 point [0.173, 9.816] · Expected Information Gain 0.0556 (sigma=0.2358)
- #3 point [0.125, 9.605] · Expected Information Gain 0.0544 (sigma=0.2333)
- #4 point [4.742, 0.311] · Expected Information Gain 0.0525 (sigma=0.2292)
- #5 point [0.34, 9.707] · Expected Information Gain 0.0505 (sigma=0.2248)
微生物 / micro_ph_control
Converging
ground-truth: Shuler & Kargi 2002 (pH control)
rmse (with accumulated data)0.4885
seed baseline rmse0.4885
95% CI coverage0.97
calibration error0.017
extrapolation honesty5.85×
closed-loop accumulated points0
Source: Shuler & Kargi 2002 (pH control)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [44.4, 4.56] · Expected Information Gain 1.1686 (sigma=1.081)
- #2 point [25.687, 8.426] · Expected Information Gain 1.1443 (sigma=1.0697)
- #3 point [25.495, 8.342] · Expected Information Gain 1.118 (sigma=1.0574)
- #4 point [43.97, 4.624] · Expected Information Gain 1.0818 (sigma=1.0401)
- #5 point [26.356, 8.383] · Expected Information Gain 1.0424 (sigma=1.021)
微生物 / micro_fba_flux
Converged
ground-truth: Edwards & Palsson 2000 (FBA framework, E. coli)
rmse (with accumulated data)0.0109
seed baseline rmse0.0109
95% CI coverage0.97
calibration error0.017
extrapolation honesty18.28×
closed-loop accumulated points0
Source: Edwards & Palsson 2000 (FBA framework, E. coli)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [0.973, 0.114] · Expected Information Gain 6.528 (sigma=2.555)
- #2 point [0.131, 0.983] · Expected Information Gain 6.5177 (sigma=2.553)
- #3 point [0.122, 0.964] · Expected Information Gain 6.4946 (sigma=2.5485)
- #4 point [0.954, 0.128] · Expected Information Gain 6.4489 (sigma=2.5395)
- #5 point [0.161, 0.974] · Expected Information Gain 6.4171 (sigma=2.5332)
微生物 / micro_dead_volume
Needs data/calibration
ground-truth: Froment & Bischoff 2012 (CSTR-in-series, dead volume)
rmse (with accumulated data)0.2011
seed baseline rmse0.2011
95% CI coverage0.97
calibration error0.017
extrapolation honesty5.81×
closed-loop accumulated points0
Source: Froment & Bischoff 2012 (CSTR-in-series, dead volume)
Next-experiment direction suggestions- Supplement points: Densify real paper data points in regions with maximum error (high curvature / inflection points); or reduce lengthscale to improve fitting.
Next-experiment tournament (ranked by information gain)- #1 point [19.43, 1.105] · Expected Information Gain 0.0368 (sigma=0.1918)
- #2 point [1.652, 7.871] · Expected Information Gain 0.0362 (sigma=0.1904)
- #3 point [1.471, 7.724] · Expected Information Gain 0.0354 (sigma=0.1881)
- #4 point [19.021, 1.217] · Expected Information Gain 0.034 (sigma=0.1845)
- #5 point [2.288, 7.795] · Expected Information Gain 0.033 (sigma=0.1818)
微生物 / micro_foam_dynamics
Converging
ground-truth: Krebes & Scharaschkin 1996 (foam in bioreactors)
rmse (with accumulated data)0.0720
seed baseline rmse0.0720
95% CI coverage0.97
calibration error0.017
extrapolation honesty6.14×
closed-loop accumulated points0
Source: Krebes & Scharaschkin 1996 (foam in bioreactors)
Next-experiment direction suggestions- Critical convergence: Relative error 8.0%, still 3.0 percentage points away from the 5% convergence line.Recommend supplementing only one real value at the tournament top-1 candidate points (locations with maximum posterior variance) and retest—This is the minimal cost cross-line path, avoiding overfitting that causes false confidence.
Next-experiment tournament (ranked by information gain)- #1 point [1.943, 0.008] · Expected Information Gain 0.1036 (sigma=0.3218)
- #2 point [0.165, 0.491] · Expected Information Gain 0.1012 (sigma=0.3181)
- #3 point [0.147, 0.48] · Expected Information Gain 0.0989 (sigma=0.3146)
- #4 point [1.902, 0.016] · Expected Information Gain 0.096 (sigma=0.3099)
- #5 point [0.229, 0.485] · Expected Information Gain 0.0923 (sigma=0.3037)
微生物 / micro_sensor_fusion
Converged
ground-truth: Gelb 1974 (Kalman filter / Bayesian fusion)
rmse (with accumulated data)0.0283
seed baseline rmse0.0283
95% CI coverage0.93
calibration error0.017
extrapolation honesty5.05×
closed-loop accumulated points0
Source: Gelb 1974 (Kalman filter / Bayesian fusion)
Next-experiment direction suggestions- [OK] Converged: Can Increase Fidelity Staircase (PINN / Neural Operator) or Serve as Cross-Domain Calibration Anchor;New direction: Use this scenario to validate the transferability of other domain agents.
Next-experiment tournament (ranked by information gain)- #1 point [9.73, 0.174] · Expected Information Gain 0.1457 (sigma=0.3818)
- #2 point [1.309, 4.91] · Expected Information Gain 0.1432 (sigma=0.3784)
- #3 point [1.223, 4.807] · Expected Information Gain 0.1398 (sigma=0.3739)
- #4 point [9.536, 0.252] · Expected Information Gain 0.135 (sigma=0.3675)
- #5 point [1.61, 4.856] · Expected Information Gain 0.1307 (sigma=0.3615)