# Molecular prediction on SIDER full-shot (test) Source: [Molecular prediction on SIDER full-shot (test)]() Collection index: [llms.txt]() Data updated: 2026-05-18T06:27:30.085Z Evaluation of model performance on molecular prediction tasks using the full-shot setting on the test split of the SIDER dataset, typically measured by ROC-AUC. A research result applies to its stated dataset, split, metric and evaluation configuration. Compare like-for-like settings, preserve the metric's unit and direction, and distinguish paper-reported results from independent reproduction. The best result recorded here is not a claim of exhaustive, current global coverage. | Scope | Recorded value | | --- | --- | | Task | Molecular prediction | | Dataset (including any stated split) | SIDER full-shot (test) | | Metric | ROC-AUC | | Unit | PERCENT | | Direction | Higher is better | | Results loaded | 25 of 25 | | Coverage | All results currently returned for this benchmark | Evaluation settings may differ between results. The original papers and recorded configurations are needed to establish comparability. A shared metric name alone does not establish an identical protocol. ## Metrics - [ROC-AUC](): Higher is better; unit: PERCENT. ## Recorded results | Method | ROC-AUC | Result date | Report paper | | --- | --- | --- | --- | | SUPThard | 68.82 | Not recorded | 68fa72361e209131cea54f7c | | SUPTsoft | 68.68 | Not recorded | 68fa72361e209131cea54f7c | | GPF-plus | 68.53 | Not recorded | 68fa72361e209131cea54f7c | | GPF | 68.19 | Not recorded | 68fa72361e209131cea54f7c | | SUPTsoft | 66.95 | Not recorded | 68fa72361e209131cea54f7c | | SUPThard | 66.85 | Not recorded | 68fa72361e209131cea54f7c | | FT | 66.77 | Not recorded | 68fa72361e209131cea54f7c | | GPF | 66.71 | Not recorded | 68fa72361e209131cea54f7c | | GPF-plus | 66.61 | Not recorded | 68fa72361e209131cea54f7c | | SUPTsoft | 66.48 | Not recorded | 68fa72361e209131cea54f7c | | SUPThard | 66.37 | Not recorded | 68fa72361e209131cea54f7c | | GPF-plus | 66.32 | Not recorded | 68fa72361e209131cea54f7c | | GPF-plus | 65.89 | Not recorded | 68fa72361e209131cea54f7c | | SUPTsoft | 65.88 | Not recorded | 68fa72361e209131cea54f7c | | SUPThard | 65.78 | Not recorded | 68fa72361e209131cea54f7c | | GPF | 65.64 | Not recorded | 68fa72361e209131cea54f7c | | GPF | 65.31 | Not recorded | 68fa72361e209131cea54f7c | | FT | 64.45 | Not recorded | 68fa72361e209131cea54f7c | | FT | 64.35 | Not recorded | 68fa72361e209131cea54f7c | | FT | 63.34 | Not recorded | 68fa72361e209131cea54f7c | | SUPTsoft | 62.84 | Not recorded | 68fa72361e209131cea54f7c | | SUPThard | 62.51 | Not recorded | 68fa72361e209131cea54f7c | | GPF-plus | 61.57 | Not recorded | 68fa72361e209131cea54f7c | | GPF | 61 | Not recorded | 68fa72361e209131cea54f7c | | FT | 60.63 | Not recorded | 68fa72361e209131cea54f7c | ### SUPThard ROC-AUC: 68.82. Result ID: 6a0ab07e47f34ce924f016d7. [Reporting paper]() [Method origin paper]() Recorded evaluation configuration: {"Pre-training Strategy":"AttrMasking"}. This record does not assert independent reproduction. ### SUPTsoft ROC-AUC: 68.68. Result ID: 6a0ab07e47f34ce924f016d8. [Reporting paper]() [Method origin paper]() Recorded evaluation configuration: {"Pre-training Strategy":"AttrMasking"}. This record does not assert independent reproduction. ### GPF-plus ROC-AUC: 68.53. Result ID: 6a0ab07e47f34ce924f016d6. [Reporting paper]() [Method origin paper]() [Implementation]() Recorded evaluation configuration: {"Pre-training Strategy":"AttrMasking"}. This record does not assert independent reproduction. ### GPF ROC-AUC: 68.19. Result ID: 6a0ab07e47f34ce924f016d5. [Reporting paper]() [Method origin paper]() [Implementation]() Recorded evaluation configuration: {"Pre-training Strategy":"AttrMasking"}. This record does not assert independent reproduction. ### SUPTsoft ROC-AUC: 66.95. Result ID: 6a0ab07e47f34ce924f016e7. [Reporting paper]() [Method origin paper]() Recorded evaluation configuration: {"Pre-training Strategy":"EdgePred"}. This record does not assert independent reproduction. ### SUPThard ROC-AUC: 66.85. Result ID: 6a0ab07e47f34ce924f016e6. [Reporting paper]() [Method origin paper]() Recorded evaluation configuration: {"Pre-training Strategy":"EdgePred"}. This record does not assert independent reproduction. ### FT ROC-AUC: 66.77. Result ID: 6a0ab07e47f34ce924f016d4. [Reporting paper]() Recorded evaluation configuration: {"Pre-training Strategy":"AttrMasking"}. This record does not assert independent reproduction. ### GPF ROC-AUC: 66.71. Result ID: 6a0ab07e47f34ce924f016e4. [Reporting paper]() [Method origin paper]() [Implementation]() Recorded evaluation configuration: {"Pre-training Strategy":"EdgePred"}. This record does not assert independent reproduction. ### GPF-plus ROC-AUC: 66.61. Result ID: 6a0ab07e47f34ce924f016e5. [Reporting paper]() [Method origin paper]() [Implementation]() Recorded evaluation configuration: {"Pre-training Strategy":"EdgePred"}. This record does not assert independent reproduction. ### SUPTsoft ROC-AUC: 66.48. Result ID: 6a0ab07e47f34ce924f016dd. [Reporting paper]() [Method origin paper]() Recorded evaluation configuration: {"Pre-training Strategy":"ContextPred"}. This record does not assert independent reproduction. ### SUPThard ROC-AUC: 66.37. Result ID: 6a0ab07e47f34ce924f016dc. [Reporting paper]() [Method origin paper]() Recorded evaluation configuration: {"Pre-training Strategy":"ContextPred"}. This record does not assert independent reproduction. ### GPF-plus ROC-AUC: 66.32. Result ID: 6a0ab07e47f34ce924f016db. [Reporting paper]() [Method origin paper]() [Implementation]() Recorded evaluation configuration: {"Pre-training Strategy":"ContextPred"}. This record does not assert independent reproduction. ### GPF-plus ROC-AUC: 65.89. Result ID: 6a0ab07e47f34ce924f016d1. [Reporting paper]() [Method origin paper]() [Implementation]() Recorded evaluation configuration: {"Pre-training Strategy":"Infomax"}. This record does not assert independent reproduction. ### SUPTsoft ROC-AUC: 65.88. Result ID: 6a0ab07e47f34ce924f016d3. [Reporting paper]() [Method origin paper]() Recorded evaluation configuration: {"Pre-training Strategy":"Infomax"}. This record does not assert independent reproduction. ### SUPThard ROC-AUC: 65.78. Result ID: 6a0ab07e47f34ce924f016d2. [Reporting paper]() [Method origin paper]() Recorded evaluation configuration: {"Pre-training Strategy":"Infomax"}. This record does not assert independent reproduction. ### GPF ROC-AUC: 65.64. Result ID: 6a0ab07e47f34ce924f016d0. [Reporting paper]() [Method origin paper]() [Implementation]() Recorded evaluation configuration: {"Pre-training Strategy":"Infomax"}. This record does not assert independent reproduction. ### GPF ROC-AUC: 65.31. Result ID: 6a0ab07e47f34ce924f016da. [Reporting paper]() [Method origin paper]() [Implementation]() Recorded evaluation configuration: {"Pre-training Strategy":"ContextPred"}. This record does not assert independent reproduction. ### FT ROC-AUC: 64.45. Result ID: 6a0ab07e47f34ce924f016d9. [Reporting paper]() Recorded evaluation configuration: {"Pre-training Strategy":"ContextPred"}. This record does not assert independent reproduction. ### FT ROC-AUC: 64.35. Result ID: 6a0ab07e47f34ce924f016e3. [Reporting paper]() Recorded evaluation configuration: {"Pre-training Strategy":"EdgePred"}. This record does not assert independent reproduction. ### FT ROC-AUC: 63.34. Result ID: 6a0ab07e47f34ce924f016cf. [Reporting paper]() Recorded evaluation configuration: {"Pre-training Strategy":"Infomax"}. This record does not assert independent reproduction. ### SUPTsoft ROC-AUC: 62.84. Result ID: 6a0ab07e47f34ce924f016e2. [Reporting paper]() [Method origin paper]() Recorded evaluation configuration: {"Pre-training Strategy":"GCL"}. This record does not assert independent reproduction. ### SUPThard ROC-AUC: 62.51. Result ID: 6a0ab07e47f34ce924f016e1. [Reporting paper]() [Method origin paper]() Recorded evaluation configuration: {"Pre-training Strategy":"GCL"}. This record does not assert independent reproduction. ### GPF-plus ROC-AUC: 61.57. Result ID: 6a0ab07e47f34ce924f016e0. [Reporting paper]() [Method origin paper]() [Implementation]() Recorded evaluation configuration: {"Pre-training Strategy":"GCL"}. This record does not assert independent reproduction. ### GPF ROC-AUC: 61. Result ID: 6a0ab07e47f34ce924f016df. [Reporting paper]() [Method origin paper]() [Implementation]() Recorded evaluation configuration: {"Pre-training Strategy":"GCL"}. This record does not assert independent reproduction. ### FT ROC-AUC: 60.63. Result ID: 6a0ab07e47f34ce924f016de. [Reporting paper]() Recorded evaluation configuration: {"Pre-training Strategy":"GCL"}. This record does not assert independent reproduction. Page 1 of 1. 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