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DFT and DFT ML Hybrid Approaches for Biological Entities Ruby Srivastava
DFT and DFT ML Hybrid Approaches for Biological Entities
Ruby Srivastava
This book explores the integration of DFT, MD simulations, and hydrogen-bonding analyses in biologically relevant systems, while highlighting the principles, advantages, limitations, and emerging applications of DFT–ML with XAI-MD approaches in biomolecular research and the rational design of metalloenzymes as advanced biocatalysts.
| Medios de comunicación | Libros Hardcover Book (Libro con lomo y cubierta duros) |
| Pendiente de lanzamiento | 5 de febrero de 2027 |
| ISBN13 | 9781041306283 |
| Editores | Taylor & Francis Ltd |
| Páginas | 248 |
| Dimensiones | 150 × 220 × 20 mm · 529 g (Peso (estimado)) |
| Lengua | Inglés |