Bidirectional Generation of Structure and Properties Through a Single Molecular Foundation Model

19 November 2022

Papers citing "Bidirectional Generation of Structure and Properties Through a Single Molecular Foundation Model"

4 / 4 papers shown

Title
polyBERT: A chemical language model to enable fully machine-driven ultrafast polymer informatics Christopher Kuenneth R. Ramprasad 26 99 0 29 Sep 2022
Can Pre-trained Models Really Learn Better Molecular Representations for AI-aided Drug Discovery? Ziqiao Zhang Yatao Bian Ailin Xie Peng Han Long-Kai Huang Shuigeng Zhou 23 5 0 21 Aug 2022
Emerging Properties in Self-Supervised Vision Transformers Mathilde Caron Hugo Touvron Ishan Misra Hervé Jégou Julien Mairal Piotr Bojanowski Armand Joulin 283 5,723 0 29 Apr 2021
MoleculeNet: A Benchmark for Molecular Machine Learning Zhenqin Wu Bharath Ramsundar Evan N. Feinberg Joseph Gomes C. Geniesse Aneesh S. Pappu K. Leswing Vijay S. Pande OOD 157 1,748 0 02 Mar 2017