Drug Discovery on ChEBI-20

Metric: Frechet ChemNet Distance (FCD) (higher is better)

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#	Model↕	Frechet ChemNet Distance (FCD)▼	Extra Data	Paper	Date↕	Code
1	MolT5-small	2.49	No	Translation between Molecules and Natural Language	2022-04-25	Code
2	MolT5-base	2.18	No	Translation between Molecules and Natural Language	2022-04-25	Code
3	MolT5-Large	1.2	No	Translation between Molecules and Natural Language	2022-04-25	Code
4	TGM-DLM w/o corr	0.89	No	Text-Guided Molecule Generation with Diffusion L...	2024-02-20	Code
5	TGM-DLM	0.77	No	Text-Guided Molecule Generation with Diffusion L...	2024-02-20	Code
6	MolReGPT (GPT-3.5-turbo)	0.57	No	Empowering Molecule Discovery for Molecule-Capti...	2023-06-11	Code
7	MolXPT	0.45	No	MolXPT: Wrapping Molecules with Text for Generat...	2023-05-18	Code
8	MolT5-Large-HV	0.44	No	Translation between Molecules and Natural Language	2022-04-25	Code
9	BioT5	0.43	No	BioT5: Enriching Cross-modal Integration in Biol...	2023-10-11	Code
10	MolReGPT (GPT-4-0413)	0.41	No	Empowering Molecule Discovery for Molecule-Capti...	2023-06-11	Code
11	BioT5+	0.353	No	BioT5+: Towards Generalized Biological Understan...	2024-02-27	Code
12	LDMol	0.2	No	LDMol: Text-to-Molecule Diffusion Model with Str...	2024-05-28	Code
13	Text+Chem T5 small	0.066	No	Unifying Molecular and Textual Representations v...	2023-01-29	Code
14	Text+Chem T5 base	0.061	No	Unifying Molecular and Textual Representations v...	2023-01-29	Code
15	Text+Chem T5-augm small	0.06	No	Unifying Molecular and Textual Representations v...	2023-01-29	Code
16	Text+Chem T5-augm base	0.05	No	Unifying Molecular and Textual Representations v...	2023-01-29	Code

#1MolT5-smallSOTA
2.49
Frechet ChemNet Distance (FCD)· 2022-04-25
Translation between Molecules and Natural Language Code
#2MolT5-base
2.18
Frechet ChemNet Distance (FCD)· 2022-04-25
Translation between Molecules and Natural Language Code
#3MolT5-Large
1.2
Frechet ChemNet Distance (FCD)· 2022-04-25
Translation between Molecules and Natural Language Code
#4TGM-DLM w/o corr
0.89
Frechet ChemNet Distance (FCD)· 2024-02-20
Text-Guided Molecule Generation with Diffusion Language Model Code
#5TGM-DLM
0.77
Frechet ChemNet Distance (FCD)· 2024-02-20
Text-Guided Molecule Generation with Diffusion Language Model Code
#6MolReGPT (GPT-3.5-turbo)
0.57
Frechet ChemNet Distance (FCD)· 2023-06-11
Empowering Molecule Discovery for Molecule-Caption Translation with Large Language Models: A ChatGPT Perspective Code
#7MolXPT
0.45
Frechet ChemNet Distance (FCD)· 2023-05-18
MolXPT: Wrapping Molecules with Text for Generative Pre-training Code
#8MolT5-Large-HV
0.44
Frechet ChemNet Distance (FCD)· 2022-04-25
Translation between Molecules and Natural Language Code
#9BioT5
0.43
Frechet ChemNet Distance (FCD)· 2023-10-11
BioT5: Enriching Cross-modal Integration in Biology with Chemical Knowledge and Natural Language Associations Code
#10MolReGPT (GPT-4-0413)
0.41
Frechet ChemNet Distance (FCD)· 2023-06-11
Empowering Molecule Discovery for Molecule-Caption Translation with Large Language Models: A ChatGPT Perspective Code
#11BioT5+
0.353
Frechet ChemNet Distance (FCD)· 2024-02-27
BioT5+: Towards Generalized Biological Understanding with IUPAC Integration and Multi-task Tuning Code
#12LDMol
0.2
Frechet ChemNet Distance (FCD)· 2024-05-28
LDMol: Text-to-Molecule Diffusion Model with Structurally Informative Latent Space Code
#13Text+Chem T5 small
0.066
Frechet ChemNet Distance (FCD)· 2023-01-29
Unifying Molecular and Textual Representations via Multi-task Language Modelling Code
#14Text+Chem T5 base
0.061
Frechet ChemNet Distance (FCD)· 2023-01-29
Unifying Molecular and Textual Representations via Multi-task Language Modelling Code
#15Text+Chem T5-augm small
0.06
Frechet ChemNet Distance (FCD)· 2023-01-29
Unifying Molecular and Textual Representations via Multi-task Language Modelling Code
#16Text+Chem T5-augm base
0.05
Frechet ChemNet Distance (FCD)· 2023-01-29
Unifying Molecular and Textual Representations via Multi-task Language Modelling Code