Cheng-Hao Liu

According to our database, Cheng-Hao Liu authored at least 9 papers between 2020 and 2024.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2024

Iterated Denoising Energy Matching for Sampling from Boltzmann Densities.

Tara Akhound-Sadegh, Jarrid Rector-Brooks, Avishek Joey Bose, Sarthak Mittal, Pablo Lemos, Cheng-Hao Liu, Marcin Sendera, Siamak Ravanbakhsh, Gauthier Gidel, Yoshua Bengio, Nikolay Malkin, Alexander Tong

CoRR, 2024

2023

Towards equilibrium molecular conformation generation with GFlowNets.

Alexandra Volokhova, Michal Koziarski, Alex Hernández-García, Cheng-Hao Liu, Santiago Miret, Pablo Lemos, Luca A. Thiede, Zichao Yan, Alán Aspuru-Guzik, Yoshua Bengio

CoRR, 2023

Diffusion Generative Flow Samplers: Improving learning signals through partial trajectory optimization.

Dinghuai Zhang, Ricky Tian Qi Chen, Cheng-Hao Liu, Aaron C. Courville, Yoshua Bengio

CoRR, 2023

SE(3)-Stochastic Flow Matching for Protein Backbone Generation.

Avishek Joey Bose, Tara Akhound-Sadegh, Kilian Fatras, Guillaume Huguet, Jarrid Rector-Brooks, Cheng-Hao Liu, Andrei Cristian Nica, Maksym Korablyov, Michael M. Bronstein, Alexander Tong

CoRR, 2023

Thompson sampling for improved exploration in GFlowNets.

Jarrid Rector-Brooks, Kanika Madan, Moksh Jain, Maksym Korablyov, Cheng-Hao Liu, Sarath Chandar, Nikolay Malkin, Yoshua Bengio

CoRR, 2023

Multi-Fidelity Active Learning with GFlowNets.

Alex Hernández-García, Nikita Saxena, Moksh Jain, Cheng-Hao Liu, Yoshua Bengio

CoRR, 2023

GFlowNets for AI-Driven Scientific Discovery.

Moksh Jain, Tristan Deleu, Jason S. Hartford, Cheng-Hao Liu, Alex Hernández-García, Yoshua Bengio

CoRR, 2023

2022

RetroGNN: Fast Estimation of Synthesizability for Virtual Screening and De Novo Design by Learning from Slow Retrosynthesis Software.

Cheng-Hao Liu, Maksym Korablyov, Stanislaw Jastrzebski, Pawel Wlodarczyk-Pruszynski, Yoshua Bengio, Marwin H. S. Segler

J. Chem. Inf. Model., 2022

2020

RetroGNN: Approximating Retrosynthesis by Graph Neural Networks for De Novo Drug Design.

Cheng-Hao Liu, Maksym Korablyov, Stanislaw Jastrzebski, Pawel Wlodarczyk-Pruszynski, Yoshua Bengio, Marwin H. S. Segler

CoRR, 2020