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ORCIDAhmed M. El Kerdawy
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Journal Articles
- 2024
[j6]Amgad Abdallah Mahmoud
, Nada Adel Alyan, Ahmed Elkerdawy, Shihori Tanabe, Frédéric Andrès, Andreas Pester, Hesham H. Ali:
Geom-SAC: Geometric Multi-Discrete Soft Actor Critic With Applications in De Novo Drug Design. IEEE Access 12: 45519-45529 (2024)- 2014
- [j5]Ahmed M. El Kerdawy, Stefan Güssregen, Hans Matter, Matthias Hennemann, Timothy Clark:
Quantum-mechanics-based molecular interaction fields for 3D-QSAR. J. Cheminformatics 6(S-1): 10 (2014) - 2013
- [j4]Ahmed M. El Kerdawy, Stefan Güssregen, Hans Matter, Matthias Hennemann, Timothy Clark:
Quantum Mechanics-Based Properties for 3D-QSAR. J. Chem. Inf. Model. 53(6): 1486-1502 (2013) - [j3]Ahmed M. El Kerdawy, Christofer S. Tautermann, Timothy Clark, Thomas Fox:
Economical and Accurate Protocol for Calculating Hydrogen-Bond-Acceptor Strengths. J. Chem. Inf. Model. 53(12): 3262-3272 (2013) - 2012
- [j2]Ahmed M. El Kerdawy, Christian R. Wick, Matthias Hennemann, Timothy Clark:
Predicting the Sites and Energies of Noncovalent Intermolecular Interactions Using Local Properties. J. Chem. Inf. Model. 52(4): 1061-1071 (2012) - 2011
- [j1]Markus Muehlbacher, Ahmed M. El Kerdawy, Christian Kramer, Brian Hudson, Timothy Clark:
Conformation-Dependent QSPR Models: logPOW. J. Chem. Inf. Model. 51(9): 2408-2416 (2011)
Conference and Workshop Papers
- 2023
- [c1]Amgad Abdallah Mahmoud, Nada Adel Alyan, Ahmed Elkerdawy, Shihori Tanabe, Frédéric Andrès, Andreas Pester, Hesham Ali:
A New Graph-Based Reinforcement Learning Environment for Targeted Molecular Generation and Optimization✱. ICSIE 2023: 52-57
Informal and Other Publications
- 2022
- [i1]Shimaa Baraka, Ahmed M. El Kerdawy:
Multimodal Transformer-based Model for Buchwald-Hartwig and Suzuki-Miyaura Reaction Yield Prediction. CoRR abs/2204.14062 (2022)
Coauthor Index
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