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19962026
most citedJunction Tree Variational Autoencoder for Molecular Graph Generation

828 citations · 5.6k across the 171 of their papers we have counts for

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Showing 2019Show all

17 papers · 1 filter

cs.LG2019★ 3 cited

Unsupervised Hierarchy Matching with Optimal Transport over Hyperbolic Spaces

David Alvarez-Melis, Youssef Mroueh, Tommi S. Jaakkola

This paper focuses on the problem of unsupervised alignment of hierarchical data such as ontologies or lexical databases. This is a problem that appears across areas, from natural…

cs.LG2019★ 42 cited

A Game Theoretic Approach to Class-wise Selective Rationalization

Shiyu Chang, Yang Zhang, Mo Yu +1

Selection of input features such as relevant pieces of text has become a common technique of highlighting how complex neural predictors operate. The selection can be optimized post…

cs.LG2019★ 52 cited

Learning to Make Generalizable and Diverse Predictions for Retrosynthesis

Benson Chen, Tianxiao Shen, Tommi S. Jaakkola +1

We propose a new model for making generalizable and diverse retrosynthetic reaction predictions. Given a target compound, the task is to predict the likely chemical reactants to pr…

cs.CL2019★ 5 cited

Rethinking Cooperative Rationalization: Introspective Extraction and Complement Control

Mo Yu, Shiyu Chang, Yang Zhang +1

Selective rationalization has become a common mechanism to ensure that predictive models reveal how they use any available features. The selection may be soft or hard, and identifi…

cs.LG2019★ 8 cited

Oblique Decision Trees from Derivatives of ReLU Networks

Guang-He Lee, Tommi S. Jaakkola

We show how neural models can be used to realize piece-wise constant functions such as decision trees. The proposed architecture, which we call locally constant networks, builds on…

cs.LG2019★ 16 cited

Towards Robust, Locally Linear Deep Networks

Guang-He Lee, David Alvarez-Melis, Tommi S. Jaakkola

Deep networks realize complex mappings that are often understood by their locally linear behavior at or around points of interest. For example, we use the derivative of the mapping…