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5. Appendice
5.1 Alternative methods
Without claiming to be exhaustive, the aim here is to list other methods that can be used with the same objective as molecular dynamics, in order to guide the user in choosing the most suitable method.
SCROLL TO TOP5.1.1 Molecular quasi-static or atomic quasi-static
This method is used to calculate the minimum potential energy of a set of atoms or molecules at absolute zero (0 K). The resulting state of matter is called the ground state. This state is sought by minimizing the potential...
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Appendice
References
Websites
Below are just a few links to information on program libraries, the use of computer resources, online courses and much more. The list is far from exhaustive, but the links offered on these sites represent a very interesting opening onto the community of molecular dynamics users.
IDRIS (Institut de développement et de ressources en informatique scientifique du CNRS) is both a resource...
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