MOFormer: Self-Supervised Transformer model for Metal-Organic Framework Property Prediction

25 October 2022

Papers citing "MOFormer: Self-Supervised Transformer model for Metal-Organic Framework Property Prediction"

22 / 22 papers shown

Title
34 Examples of LLM Applications in Materials Science and Chemistry: Towards Automation, Assistants, Agents, and Accelerated Scientific Discovery Yoel Zimmermann Adib Bazgir Alexander H Al-Feghali Mehrad Ansari L. C. Brinson ... Shang Zhu Jan Janssen Calvin Li Ian Foster Ben Blaiszik 99 1 0 05 May 2025
TransPolymer: a Transformer-based language model for polymer property predictions Changwen Xu Yuyang Wang A. Farimani 74 89 0 03 Sep 2022
Crystal Twins: Self-supervised Learning for Crystalline Material Property Prediction Rishikesh Magar Yuyang Wang Amir Barati Farimani 51 57 0 04 May 2022
Improving Molecular Contrastive Learning via Faulty Negative Mitigation and Decomposed Fragment Contrast Yuyang Wang Rishikesh Magar Chen Liang A. Farimani 66 78 0 18 Feb 2022
Using Machine Learning and Data Mining to Leverage Community Knowledge for the Engineering of Stable Metal-Organic Frameworks Aditya Nandy Chenru Duan Heather J. Kulik AI4CE 39 118 0 24 Jun 2021
Barlow Twins: Self-Supervised Learning via Redundancy Reduction Jure Zbontar Li Jing Ishan Misra Yann LeCun Stéphane Deny SSL 276 2,338 0 04 Mar 2021
Mapping the Space of Chemical Reactions Using Attention-Based Neural Networks P. Schwaller Daniel Probst Alain C. Vaucher Vishnu H. Nair D. Kreutter Teodoro Laino J. Reymond 175 229 0 09 Dec 2020
Exploring Simple Siamese Representation Learning Xinlei Chen Kaiming He SSL 245 4,036 0 20 Nov 2020
An Image is Worth 16x16 Words: Transformers for Image Recognition at Scale Alexey Dosovitskiy Lucas Beyer Alexander Kolesnikov Dirk Weissenborn Xiaohua Zhai ... Matthias Minderer G. Heigold Sylvain Gelly Jakob Uszkoreit N. Houlsby ViT 530 40,739 0 22 Oct 2020
ProtTrans: Towards Cracking the Language of Life's Code Through Self-Supervised Deep Learning and High Performance Computing Ahmed Elnaggar M. Heinzinger Christian Dallago Ghalia Rehawi Yu Wang ... Tamas B. Fehér Christoph Angerer Martin Steinegger D. Bhowmik B. Rost DRL 52 938 0 13 Jul 2020
PyTorch: An Imperative Style, High-Performance Deep Learning Library Adam Paszke Sam Gross Francisco Massa Adam Lerer James Bradbury ... Sasank Chilamkurthy Benoit Steiner Lu Fang Junjie Bai Soumith Chintala ODL 361 42,299 0 03 Dec 2019
RoBERTa: A Robustly Optimized BERT Pretraining Approach Yinhan Liu Myle Ott Naman Goyal Jingfei Du Mandar Joshi Danqi Chen Omer Levy M. Lewis Luke Zettlemoyer Veselin Stoyanov AIMat 518 24,351 0 26 Jul 2019
A Multiscale Visualization of Attention in the Transformer Model Jesse Vig ViT 77 577 0 12 Jun 2019
DScribe: Library of Descriptors for Machine Learning in Materials Science Lauri Himanen M. Jäger Eiaki V. Morooka F. F. Canova Y. S. Ranawat D. Gao Patrick Rinke A. Foster 46 576 0 18 Apr 2019
Molecular Transformer - A Model for Uncertainty-Calibrated Chemical Reaction Prediction P. Schwaller Teodoro Laino John McGuinness A. Horváth Constantine Bekas A. Lee 103 737 0 06 Nov 2018
BERT: Pre-training of Deep Bidirectional Transformers for Language Understanding Jacob Devlin Ming-Wei Chang Kenton Lee Kristina Toutanova VLM SSL SSeg 1.5K 94,511 0 11 Oct 2018
"Found in Translation": Predicting Outcomes of Complex Organic Chemistry Reactions using Neural Sequence-to-Sequence Models P. Schwaller T. Gaudin D. Lanyi C. Bekas Teodoro Laino 70 281 0 13 Nov 2017
Attention Is All You Need Ashish Vaswani Noam M. Shazeer Niki Parmar Jakob Uszkoreit Llion Jones Aidan Gomez Lukasz Kaiser Illia Polosukhin 3DV 628 130,942 0 12 Jun 2017
Layer Normalization Jimmy Lei Ba J. Kiros Geoffrey E. Hinton 338 10,467 0 21 Jul 2016
XGBoost: A Scalable Tree Boosting System Tianqi Chen Carlos Guestrin 613 38,735 0 09 Mar 2016
Deep Residual Learning for Image Recognition Kaiming He Xinming Zhang Shaoqing Ren Jian Sun MedIm 1.9K 193,426 0 10 Dec 2015
Neural Machine Translation by Jointly Learning to Align and Translate Dzmitry Bahdanau Kyunghyun Cho Yoshua Bengio AIMat 505 27,263 0 01 Sep 2014