A Data-driven Discovery Pipeline for Flue Gas Separation Homopolymer Membranes
- Hsianghan Hsu
- Matteo Manica
- et al.
- 2022
- MRS Fall Meeting 2022
Publications
Date
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507 results for Accelerated Discovery
Self-Supervised Representations of Geo-located Weather Time Series - an Evaluation and Analysis
- Arjun Ashok
- Devyani Lambhate
- et al.
- 2022
- AAAI-FS 2022
Bayesian Optimization for Field-Scale Geological Carbon Storage
- Xyeying Lu
- Kirk Jordan
- et al.
- 2022
- Engineering
Deep learning assisted Suzuki cross coupling catalyst design
- Oliver Schilter
- Federico Zipoli
- et al.
- 2022
- ACS Fall 2022
Combining high-quality, humanly curated data with language models: the dawn of on-demand machine learning models for digital chemistry
- Alain Vaucher
- Fiona Shortt de Hernandez
- et al.
- 2022
- ACS Fall 2022
Bridging the gap between rule-based expert systems and machine learning in computer-aided retrosynthetic design
- Daniel Probst
- Anastasia Sveshnikova
- et al.
- 2022
- ACS Fall 2022
Augmented disconnection aware retrosynthesis to facilitate user interaction
- Amol Thakkar
- Andrea Antonia Byekwaso
- et al.
- 2022
- ACS Fall 2022
Large scale density estimation with polynomial expansions and Johnson-Lindenstrauss transformations
- Aleksandros Sobczyk
- Teodoro Laino
- et al.
- 2022
- ACS Fall 2022
Guiding multistep retrosynthesis planning with continuous pathway representations
- Jannis Born
- Matteo Manica
- et al.
- 2022
- ACS Fall 2022
Towards an Approximation-Aware Computational Workflow Framework for Accelerating Large-Scale Discovery Tasks
- Michael A. Johnston
- Vassils Vassiliadis
- 2022
- ApPLIED 2022