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drug design

28 papers

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Co-occurring keywords

molecular generation (78) graph neural network (3962) diffusion model (3751) molecule generation (58) drug discovery (119) reinforcement learning (4352) molecular design (26) property prediction (38) generative model (2892) molecular representation (64)

Papers

CogMol: Target-Specific and Selective Drug Design for COVID-19 Using Deep Generative Models NIPS 2020
Learning to Navigate The Synthetically Accessible Chemical Space Using Reinforcement Learning ICML 2020
Communicative Representation Learning on Attributed Molecular Graphs IJCAI 2020