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Equilibration of a Molecular Biological System Simulation,This chapter introduces the setup protocol for preparing a molecular biological system simulation in explicit solvent. The energy minimisation methods are discussed in details. Furthermore, the complete protocol of the equilibration of solvent is shown for a protein system in explicit solvent.SPECT 发表于 2025-3-25 08:37:04
Normal Mode Analysis,This chapter introduces the normal mode analysis of a protein, which is associated with the energy minimisation.镇痛剂 发表于 2025-3-25 15:41:40
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https://doi.org/10.1007/978-3-031-34839-6Quantum Mechanics Simulations; Coarse-Grained Models; Semi-Empirical Models; Software Trends; Molecular闪光东本 发表于 2025-3-26 09:17:40
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Computer Simulations in Molecular Biology978-3-031-34839-6Series ISSN 1434-8322 Series E-ISSN 2198-2589Prostaglandins 发表于 2025-3-26 18:23:04
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