Table 3.
Overview of the Stage 3 follow-ups enumeration submissions. 4 sets of predictions were submitted for stage 3. The first, second, third and fourth columns correspond to the submission identification number (SID), the affiliation of the participants, the method’s name and the list of software used
| SID | Participant Affiliation | Method Name | Method category | Software used |
|---|---|---|---|---|
| 82 | Peking University | XGboost_gnina_Yu | Docking, ML |
rdkit xgboost gnina |
| 85 | Acellera | SkeleDock-rDock | Docking |
SkeleDock RDKit HTMD rDock |
| 86 | Institut de Chimie des Substances Naturelles, CNRS, Gif-sur-Yvette, France | ranking_stage3 | Docking |
Schrodinger LigPrep v48012 CACTVS Chemoinformatics Toolkit V3.4.6.26 CORINA v4.2.0 CCDC GOLD v5.7.1 (CSDS-2019-1) |
| 87 |
The University of Tokyo, Japan SHaLX Inc. |
Template filtering then template docking | Docking |
RDKit (2018.09.1) Molegro Virtual Docker (7.0.0) |