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Analysis of phase stability,elastic, electronic,thermal, and optical properties of Sc1-xYxN via ab initio methods |
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| Authors: | Gagui S Meradji H Ghemid S Naeem S Haq Bakhtiar Ul Ahmed R Kushwaha A K |
| Institution: | 1.School of Computer Science, University of Buckingham, Hunter Street, Buckingham, MK18 1EG, UK ;2.University of West London, St Mary’s Road, Ealing, London, W5 5RF, UK ;3.Oxford Drug Design Ltd., Oxford Centre for Innovation, New Road, Oxford, OX1 1BY, UK ; |
| Abstract: | Journal of Molecular Modeling - The recent advances in the application of machine learning to drug discovery have made it a ‘hot topic’ for research, with hundreds of academic groups... |
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