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  "access_rights": "",
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  "author": "Gebauer et al.",
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  "author": "Gebauer et al.",
            
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  "author_email": "",
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  "author_email": "",
            
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  "citation": [],
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  "creator_user_id": "17755db4-395a-4b3b-ac09-e8e3484ca700",
            
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  "defined_in": "https://doi.org/10.48550/arXiv.2305.07508",
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  "defined_in": "https://doi.org/10.48550/arXiv.2305.07508",
            
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  "doi": "10.57702/pxpo3ugi",
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  "doi": "10.57702/pxpo3ugi",
            
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  "doi_date_published": null,
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  "doi_date_published": "2024-12-03",
            
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  "doi_publisher": "TIB",
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  "doi_publisher": "TIB",
            
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  "extra_authors": [
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  "extra_authors": [
            
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    {
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    {
            
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      "extra_author": "Luo & Ji",
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      "extra_author": "Luo & Ji",
            
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      "orcid": ""
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      "orcid": ""
            
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    },
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    {
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    {
            
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      "extra_author": "Li et al.",
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      "extra_author": "Li et al.",
            
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      "orcid": ""
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      "orcid": ""
            
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    },
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    },
            
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    {
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    {
            
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      "extra_author": "Liu et al.",
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      "extra_author": "Liu et al.",
            
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      "orcid": ""
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      "orcid": ""
            
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    },
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    },
            
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    {
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    {
            
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      "extra_author": "Peng et al.",
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      "extra_author": "Peng et al.",
            
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      "orcid": ""
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      "orcid": ""
            
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    },
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    },
            
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    {
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    {
            
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      "extra_author": "Roney et al.",
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      "extra_author": "Roney et al.",
            
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      "orcid": ""
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      "orcid": ""
            
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    },
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    },
            
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    {
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    {
            
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      "extra_author": "Schneuing et al.",
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      "extra_author": "Schneuing et al.",
            
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      "orcid": ""
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      "orcid": ""
            
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    },
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    },
            
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    {
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    {
            
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      "extra_author": "Wu et al.",
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      "extra_author": "Wu et al.",
            
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      "orcid": ""
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      "orcid": ""
            
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    },
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    },
            
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    {
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    {
            
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      "extra_author": "Xu et al.",
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      "extra_author": "Xu et al.",
            
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      "orcid": ""
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      "orcid": ""
            
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    },
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    },
            
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    {
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    {
            
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      "extra_author": "You et al.",
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      "extra_author": "You et al.",
            
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      "orcid": ""
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      "orcid": ""
            
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    },
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    },
            
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    {
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    {
            
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      "extra_author": "Zhou et al.",
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      "extra_author": "Zhou et al.",
            
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      "orcid": ""
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      "orcid": ""
            
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    }
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    }
            
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  ],
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      "description": "",
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      "description": "",
            
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      "name": "3d-molecule-generation",
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      "name": "3d-molecule-generation",
            
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      "title": "3D Molecule Generation"
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      "title": "3D Molecule Generation"
            
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    },
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    {
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    {
            
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      "description": "",
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      "description": "",
            
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      "display_name": "Molecule Generation",
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      "display_name": "Molecule Generation",
            
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      "name": "molecule-generation",
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      "name": "molecule-generation",
            
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      "title": "Molecule Generation"
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      "title": "Molecule Generation"
            
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    }
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  ],
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  "license_title": null,
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  "link_orkg": "",
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  "metadata_created": "2024-12-03T09:53:34.590719",
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  "name": "geom-drug",
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  "name": "geom-drug",
            
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  "notes": "Small molecule drugs perform biological functions by 
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  "notes": "Small molecule drugs perform biological functions by 
            
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binding to particular protein pockets based on their 3D structures. 
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binding to particular protein pockets based on their 3D structures. 
            
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Recently, both academia and industry started to focus on designing 
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Recently, both academia and industry started to focus on designing 
            
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small molecule drugs in the 3D space instead of only using 2D 
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small molecule drugs in the 3D space instead of only using 2D 
            
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graphs.",
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graphs.",
            
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    "approval_status": "approved",
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    "approval_status": "approved",
            
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      "description": "The json representation of the dataset with its 
            
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distributions based on DCAT.",
            
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      "format": "JSON",
            
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      "hash": "",
            
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      "name": "drug design",
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      "name": "molecule generation",
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  "title": "GEOM-Drug",
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  "title": "GEOM-Drug",
            
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  "type": "dataset",
            
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  "version": ""
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  "version": ""
            
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}
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}