Improving Small Molecule Generation using Mutual Information Machine

Improving Small Molecule Generation using Mutual Information Machine

18 August 2022

Daniel A. Reidenbach

Papers citing "Improving Small Molecule Generation using Mutual Information Machine"

10 / 10 papers shown

Title
Learning Natural Language Constraints for Safe Reinforcement Learning of Language Agents Jaymari Chua Chen Wang Lina Yao ALM 40 0 0 04 Apr 2025
cMIM: A Contrastive Mutual Information Framework for Unified Generative and Discriminative Representation Learning Micha Livne SSL 60 0 0 27 Feb 2025
nach0: Multimodal Natural and Chemical Languages Foundation Model M. Livne Z. Miftahutdinov E. Tutubalina Maksim Kuznetsov Daniil Polykovskiy ... Aastha Jhunjhunwala Anthony Costa Alex Aliper Alán Aspuru-Guzik Alex Zhavoronkov AI4CE 6 12 0 21 Nov 2023
CoarsenConf: Equivariant Coarsening with Aggregated Attention for Molecular Conformer Generation Danny Reidenbach Aditi S. Krishnapriyan 12 7 0 26 Jun 2023
GraphDF: A Discrete Flow Model for Molecular Graph Generation Youzhi Luo Keqiang Yan Shuiwang Ji DRL 157 185 0 01 Feb 2021
SentenceMIM: A Latent Variable Language Model M. Livne Kevin Swersky David J. Fleet VLM 27 6 0 18 Feb 2020
A deep-learning view of chemical space designed to facilitate drug discovery P. Maragakis Hunter M. Nisonoff B. Cole D. Shaw 19 28 0 07 Feb 2020
NeMo: a toolkit for building AI applications using Neural Modules Oleksii Kuchaiev Jason Chun Lok Li Huyen Nguyen Oleksii Hrinchuk Ryan Leary ... Jack Cook P. Castonguay Mariya Popova Jocelyn Huang Jonathan M. Cohen 172 287 0 14 Sep 2019
Graph Convolutional Policy Network for Goal-Directed Molecular Graph Generation Jiaxuan You Bowen Liu Rex Ying Vijay S. Pande J. Leskovec GNN 181 878 0 07 Jun 2018
Junction Tree Variational Autoencoder for Molecular Graph Generation Wengong Jin Regina Barzilay Tommi Jaakkola 208 1,205 0 12 Feb 2018