Hit and Lead Discovery with Explorative RL and Fragment-based Molecule Generation

Gespeichert in:
Bibliographische Detailangaben
Veröffentlicht in:NeurIPS (35. : 2021 : Online) 35th Conference on Neural Information Processing Systems (NeurIPS 2021) ; Volume 10 of 36
1. Verfasser: Yang, Soojung (VerfasserIn)
Weitere Verfasser: Hwang, Doyeong (VerfasserIn), Lee, Seul (VerfasserIn), Ryu, Seongok (VerfasserIn), Hwang, Sung Ju (VerfasserIn)
Pages:35
Format: UnknownFormat
Sprache:eng
Veröffentlicht: 2022
Schlagworte:
Tags: Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
Titel Jahr Verfasser
Improved Regret Bounds for Tracking Experts with Memory 2022 Robinson, James
Random Noise Defense Against Query-Based Black-Box Attacks 2022 Qin, Zeyu
Near-Optimal Offline Reinforcement Learning via Double Variance Reduction 2022 Yin, Ming
Multi-Agent Reinforcement Learning in Stochastic Networked Systems 2022 Lin, Yiheng
The future is log-Gaussian: ResNets and their infinite-depth-and-width limit at initialization 2022 Li, Mufan
Neural Ensemble Search for Uncertainty Estimation and Dataset Shift 2022 Zaidi, Sheheryar
Proxy Convexity: A Unified Framework for the Analysis of Neural Networks Trained by Gradient Descent 2022 Frei, Spencer
Open-set Label Noise Can Improve Robustness Against Inherent Label Noise 2022 Wei, Hongxin
Towards Enabling Meta-Learning from Target Models 2022 Lu, Su
A Near-Optimal Algorithm for Debiasing Trained Machine Learning Models 2022 Alabdulmohsin, Ibrahim
GENESIS-V2: Inferring Unordered Object Representations without Iterative Refinement 2022 Engelcke, Martin
Rethinking gradient sparsification as total error minimization 2022 Sahu, Atal
Combining Latent Space and Structured Kernels for Bayesian Optimization over Combinatorial Spaces 2022 Deshwal, Aryan
Learning Signal-Agnostic Manifolds of Neural Fields 2022 Du, Yilun
Neural Active Learning with Performance Guarantees 2022 Wang, Zhilei
One Question Answering Model for Many Languages with Cross-lingual Dense Passage Retrieval 2022 Asai, Akari
LEADS: Learning Dynamical Systems that Generalize Across Environments 2022 Yin, Yuan
Variance-Aware Off-Policy Evaluation with Linear Function Approximation 2022 Min, Yifei
A Provably Efficient Sample Collection Strategy for Reinforcement Learning 2022 Tarbouriech, Jean
Forster Decomposition and Learning Halfspaces with Noise 2022 Diakonikolas, Ilias
Alle Artikel auflisten