PUBLICATIONS
PUBLICATIONS
The HyperLab is constantly evolving
with the state of the art technologies
proven with the papers.
Hyper Design
Molecular generative model with conditional variational autoencoder
Journal of Cheminformatics, 10, 31 (2018)
Learn more
Hyper Design
Target-conditioned GFlowNet for Structure-based Drug Design
Transactions on Machine Learning Research
Learn more
Hyper Design
NCIDiff: Non-covalent Interaction-generative Diffusion Model for Improving Reliability of 3D Molecule Generation Inside Protein Pocket
ICML2024 Workshop AI4Science
Learn more
Hyper Design
3D molecular generative framework for interaction-guided drug design
Nature Communications 15.1 (2024): 2688.
Learn more
Hyper Design
Molecular Generative Model via Retrosynthetically Prepared Chemical Building Block Assembly
Advanced Science, 10, 2206674 (2023)
Learn more
Hyper Design
Molecular generative model based on adversarially regularized autoencoder
Journal of Chemical Information and Modeling, 60, 29 (2020)
Learn more
Hyper Design
Scaffold-based molecular design with graph generative model
Chemical Science, 11, 1153 (2020)
Learn more
Hyper Design
Molecular generative model with conditional variational autoencoder
Journal of Cheminformatics, 10, 31 (2018)
Learn more
Hyper Design
Target-conditioned GFlowNet for Structure-based Drug Design
Transactions on Machine Learning Research
Learn more
Hyper Design
NCIDiff: Non-covalent Interaction-generative Diffusion Model for Improving Reliability of 3D Molecule Generation Inside Protein Pocket
ICML2024 Workshop AI4Science
Learn more
Hyper Design
3D molecular generative framework for interaction-guided drug design
Nature Communications 15.1 (2024): 2688.
Learn more
Hyper Design
Molecular Generative Model via Retrosynthetically Prepared Chemical Building Block Assembly
Advanced Science, 10, 2206674 (2023)
Learn more
Hyper Design
Molecular generative model based on adversarially regularized autoencoder
Journal of Chemical Information and Modeling, 60, 29 (2020)
Learn more
Hyper Design
Scaffold-based molecular design with graph generative model
Chemical Science, 11, 1153 (2020)
Learn more
Hyper Design
Molecular generative model with conditional variational autoencoder
Journal of Cheminformatics, 10, 31 (2018)
Learn more
Hyper Design
Target-conditioned GFlowNet for Structure-based Drug Design
Transactions on Machine Learning Research
Learn more
Hyper Design
NCIDiff: Non-covalent Interaction-generative Diffusion Model for Improving Reliability of 3D Molecule Generation Inside Protein Pocket
ICML2024 Workshop AI4Science
Learn more
Hyper Design
3D molecular generative framework for interaction-guided drug design
Nature Communications 15.1 (2024): 2688.
Learn more
Hyper Design
Molecular Generative Model via Retrosynthetically Prepared Chemical Building Block Assembly
Advanced Science, 10, 2206674 (2023)
Learn more
Hyper Design
Molecular generative model based on adversarially regularized autoencoder
Journal of Chemical Information and Modeling, 60, 29 (2020)
Learn more
Hyper Design
Scaffold-based molecular design with graph generative model
Chemical Science, 11, 1153 (2020)
Learn more
PUBLICATIONS
The HyperLab is constantly evolving
with the state of the art technologies
proven with the papers.
Hyper Design
Molecular generative model with conditional variational autoencoder
Journal of Cheminformatics, 10, 31 (2018)
Learn more
Hyper Design
Target-conditioned GFlowNet for Structure-based Drug Design
Transactions on Machine Learning Research
Learn more
Hyper Design
NCIDiff: Non-covalent Interaction-generative Diffusion Model for Improving Reliability of 3D Molecule Generation Inside Protein Pocket
ICML2024 Workshop AI4Science
Learn more
Hyper Design
3D molecular generative framework for interaction-guided drug design
Nature Communications 15.1 (2024): 2688.
Learn more
Hyper Design
Molecular Generative Model via Retrosynthetically Prepared Chemical Building Block Assembly
Advanced Science, 10, 2206674 (2023)
Learn more
Hyper Design
Molecular generative model based on adversarially regularized autoencoder
Journal of Chemical Information and Modeling, 60, 29 (2020)
Learn more
Hyper Design
Scaffold-based molecular design with graph generative model
Chemical Science, 11, 1153 (2020)
Learn more
Hyper Design
Molecular generative model with conditional variational autoencoder
Journal of Cheminformatics, 10, 31 (2018)
Learn more
Hyper Design
Target-conditioned GFlowNet for Structure-based Drug Design
Transactions on Machine Learning Research
Learn more
Hyper Design
NCIDiff: Non-covalent Interaction-generative Diffusion Model for Improving Reliability of 3D Molecule Generation Inside Protein Pocket
ICML2024 Workshop AI4Science
Learn more
Hyper Design
3D molecular generative framework for interaction-guided drug design
Nature Communications 15.1 (2024): 2688.
Learn more
Hyper Design
Molecular Generative Model via Retrosynthetically Prepared Chemical Building Block Assembly
Advanced Science, 10, 2206674 (2023)
Learn more
Hyper Design
Molecular generative model based on adversarially regularized autoencoder
Journal of Chemical Information and Modeling, 60, 29 (2020)
Learn more
Hyper Design
Scaffold-based molecular design with graph generative model
Chemical Science, 11, 1153 (2020)
Learn more
Ready to revolutionize
Your drug discovery process?
Ready to revolutionize
your drug discovery process?
HITS Inc.
CEO : Woo Youn Kim
Address : 8F, 28, Teheran-ro 4-gil, Gangnam-gu, Seoul, Republic of Korea (06241)
Tel : +82-2-6953-0317
E-mail :
Company registration number : 260-88-01818
© 2025 HITS. All rights reserved.
HITS Inc.
CEO : Woo Youn Kim
Tel : +82-2-6953-0317
E-mail :
Company registration number : 260-88-01818
Address : 8F, 28, Teheran-ro 4-gil, Gangnam-gu, Seoul, Republic of Korea (06241)
© 2025 HITS. All rights reserved.
HITS Inc.
CEO : Woo Youn Kim
Address : 8F, 28, Teheran-ro 4-gil, Gangnam-gu, Seoul, Republic of Korea (06241)
Tel : +82-2-6953-0317
E-mail :
Company registration number : 260-88-01818
© 2025 HITS. All rights reserved.