datasets
Training and evaluation data, with the modality, task and licence stated up front. Listed live from the Hugging Face Hub.
ESOL-V-SMILES-0
ESOL-V-SMILES Dataset
Dataset Description
This dataset contains molecular data with visual representations for BACE (Beta-secretase 1) related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES… See the full description on the dataset page: https://huggingface.co/datasets/molvision/ESOL-V-SMILES-0.BACE-V-SMILES-2
BACE-V-SMILES Dataset
Dataset Description
This dataset contains molecular data with visual representations for BACE (Beta-secretase 1) related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES… See the full description on the dataset page: https://huggingface.co/datasets/molvision/BACE-V-SMILES-2.BBBP-V-SMILES-2
BBBP-V-SMILES Dataset
Dataset Description
This dataset contains molecular data with visual representations for BBBP (Beta-secretase 1) related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES… See the full description on the dataset page: https://huggingface.co/datasets/molvision/BBBP-V-SMILES-2.ESOL-V-SMILES-2
ESOL-V-SMILES Dataset
Dataset Description
This dataset contains molecular data with visual representations for BACE (Beta-secretase 1) related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES… See the full description on the dataset page: https://huggingface.co/datasets/molvision/ESOL-V-SMILES-2.TOX21-V-SMILES-2
Tox21-V-SMILES Dataset
Dataset Description
This dataset contains molecular data with visual representations for BACE (Beta-secretase 1) related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES… See the full description on the dataset page: https://huggingface.co/datasets/molvision/TOX21-V-SMILES-2.BACE-V-SMILES-4
BACE-V-SMILES Dataset
Dataset Description
This dataset contains molecular data with visual representations for BACE (Beta-secretase 1) related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES… See the full description on the dataset page: https://huggingface.co/datasets/molvision/BACE-V-SMILES-4.CLINTOX-V-SMILES-2
Clintox-V-SMILES Dataset
Dataset Description
This dataset contains molecular data with visual representations for BACE (Beta-secretase 1) related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES… See the full description on the dataset page: https://huggingface.co/datasets/molvision/CLINTOX-V-SMILES-2.TOX21-V-SMILES-4
Tox21-V-SMILES Dataset
Dataset Description
This dataset contains molecular data with visual representations for BACE (Beta-secretase 1) related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES… See the full description on the dataset page: https://huggingface.co/datasets/molvision/TOX21-V-SMILES-4.Tox21-V-SMILES-0
Tox21-V-SMILES Train Dataset
Dataset Description
This dataset contains molecular data with visual representations for Tox21 related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES
Dataset… See the full description on the dataset page: https://huggingface.co/datasets/molvision/Tox21-V-SMILES-0.BACE-V-SMILES-0
BACE-V-SMILES Train Dataset
Dataset Description
This dataset contains molecular data with visual representations for BACE related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES
Dataset Statistics… See the full description on the dataset page: https://huggingface.co/datasets/molvision/BACE-V-SMILES-0.BBBP-V-SMILES-0
BBBP-V-SMILES Train Dataset
Dataset Description
This dataset contains molecular data with visual representations for BBBP related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES
Dataset Statistics… See the full description on the dataset page: https://huggingface.co/datasets/molvision/BBBP-V-SMILES-0.ESOL-V-SMILES-4
ESOL-V-SMILES Dataset
Dataset Description
This dataset contains molecular data with visual representations for BACE (Beta-secretase 1) related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES… See the full description on the dataset page: https://huggingface.co/datasets/molvision/ESOL-V-SMILES-4.CLINTOX-V-SMILES-4
Clintox-V-SMILES Dataset
Dataset Description
This dataset contains molecular data with visual representations for BACE (Beta-secretase 1) related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES… See the full description on the dataset page: https://huggingface.co/datasets/molvision/CLINTOX-V-SMILES-4.BBBP-V-SMILES-4
BBBP-V-SMILES Dataset
Dataset Description
This dataset contains molecular data with visual representations for BACE (Beta-secretase 1) related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES… See the full description on the dataset page: https://huggingface.co/datasets/molvision/BBBP-V-SMILES-4.Clintox-V-SMILES-0
Clintox-V-SMILES Train Dataset
Dataset Description
This dataset contains molecular data with visual representations for Clintox related compounds.
Features
Question: Question related to the molecule
Answer: Corresponding answer
TargetMolecule: SMILES representation of the target molecule
SampleMethod: Method used for sampling
SampleNum: Sample number
SampleRep: Sample repetition
image: Generated molecular structure image from SMILES
Dataset… See the full description on the dataset page: https://huggingface.co/datasets/molvision/Clintox-V-SMILES-0.
