Molecular transformer-aided biocatalysed synthesis planning
- Daniel Probst
- Matteo Manica
- et al.
- 2022
- ACS Spring 2022
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26171 results for Science
Active site sequence representation of human kinases outperforms full sequence for affinity prediction and inhibitor generation: 3D effects in a 1D model
- Jannis Born
- Tien Huynh
- et al.
- 2022
- ACS Spring 2022
Dzyaloshinskii-Moriya interaction in Pt/Co/Re films
- Akiyo Nomura
- Tenghua Gao
- et al.
- 2022
- APS March Meeting 2022
Unsupervised Causal Knowledge Extraction from Text using Natural Language Inference
- Manik Bhandari
- Mark Feblowitz
- et al.
- 2021
- AAAI 2021
ESG Accountability Made Easy: DocQA at Your Service
- Lokesh Mishra
- Cesar Berrospi Ramis
- et al.
- 2024
- AAAI 2024
LLMGuard: Guarding Against Unsafe LLM Behavior
- Shubh Goyal
- Medha Hira
- et al.
- 2024
- AAAI 2024
MANDREL: Modular Reinforcement Learning Pipelines for Material Discovery
- Clyde Fare
- George Holt
- et al.
- 2024
- AAAI 2024
DataRinse: Semantic Transforms for Data preparation based on Code Mining
- Ibrahim Abdelaziz
- Julian Dolby
- et al.
- 2023
- VLDB 2023
Expanded Dataset for Improved Prediction of Chemical Biodegradability
- Eduardo Almeida Soares
- Victor Shirasuna
- et al.
- 2023
- ACS Fall 2023
Finspector: A Human-Centered Visual Inspection Tool for Exploring and Comparing Biases among Foundation Models
- Bc Kwon
- Nandana Mihindukulasooriya
- 2023
- ACL 2023