杂色 发表于 2025-3-26 23:03:59
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Physicochemical Properties in Vacuo and in Solution of Some Molecules with Biological Significance fck methods. The speed of the computations and the reliability of the results allow us to suggest the density functional methods as tools for the study of large and complex systems such as the biologival molecules.CHOP 发表于 2025-3-27 05:29:05
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Bastian Schuchardt,Henning Grannular mobility . In many areas of molecular biology, such as muscle contraction or conformational changes in allosteric proteins, motion is self-evidently crucial. In facilitating such processes as the access of ligands to protein binding sites or in accomodating the change in protein and substratArchipelago 发表于 2025-3-28 00:41:47
Fundamentals of Large-Scale Crew Scheduling, be accounted for by the available physical concepts and does not require a new paradigm in thermodynamics or quantum mechanics. The difficulty encountered in studying these systems computationally is associated with the fact that enzymes are complex systems and the science of modeling complex syste垫子 发表于 2025-3-28 03:49:27
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Sergio Herrero-Lopez,John R. Williamsal theory in predicting the physicochemical properties in vacuo and in solution for these class of compounds..The studied systems are:.Results for the considered properties are in agreement with available experimental data and competitive with those obtained by the most sophisticated post-Hartree-Fo