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Computational Chemistry Top Journals

Computational chemistry is a branch of chemistry that uses computational simulation to assist in solving chemical problems. It uses strategies of theoretical chemistry, incorporated into efficient computer programs, to calculate the systems and properties of molecules and solids. There are two fundamental branches of computational chemistry: one is primarily based on classical mechanics, and the other is based totally on quantum mechanics. Computational Chemistry Top Journals Molecules are sufficiently small items that, strictly speaking, the legal guidelines of quantum mechanics have to be used to describe them. However, under the proper conditions, it's far still once in a while useful (and much quicker computationally) to approximate the molecule the usage of classical mechanics. This approach is sometimes known as the ``molecular mechanics'' (MM) or ``force-field'' method . All molecular mechanics strategies are empirical inside the feel that the parameters in the version are received by using becoming to recognized experimental data. Computational Chemistry  Journals covers all the topics Computational Chemistry.

 

 

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