Computational Drug Discovery: Molecular Simulation for Medicinal Chemistry
Pooja A. Chawla · Dilpreet Singh · Kamal Dua · Muralikrishnan Dhanasekaran · Viney Chawla
Okt 2024 · Walter de Gruyter GmbH & Co KG
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439
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reportUkadiriaji na maoni hayajahakikishwa Pata Maelezo Zaidi
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Computational methods and understanding computational models are important in modern drug discovery. The book focuses on computational approaches that can improve the development of in silico methodologies. It includes lead hit methods, docking algorithms, computational chiral compounds, structure-based drug design, GROMACS and NAMD, structural genomics, toxicity prediction, enzyme inhibitors and peptidomimetic therapeutics
Kuhusu mwandishi
P. A. Chawla, BFUHS, India; D. Singh, CU, India; K. Dua, ARCCIM, Australia; M. Dhanasekaran, AU, USA; V. Chawla, UIPSR, India.
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