72012AMBER

Due to market price fluctuations, if you need to purchase or consult the price. You can contact us or emial to us:   sales@allicdata.com

AMBER is an acronym for Atomic, Molecular, and Electronic Structure software. It is a scientific computer program for performing automatic calculations of molecular motion, ranging from the description of the behavior of electrons and nuclei in molecules and their reactions to the movements of large groups of molecules. The program was developed at the Lawrence Livermore National Laboratory and has been extensively used in research, both in academia and industry, for over two decades. The package is widely used in a variety of fields, from pharmaceutical research to chemical engineering.

The AMBER software package consists of several interlocking modules that work together to carry out the calculations. At the highest level, the modules can be divided into three categories: force fields, which describe the interactions between atoms and molecules; force fields parameterization, which sets the parameters of the force fields; and the subroutine library, which provides the subroutines required for the calculations of the forces and the analysis of the results. Each of these categories can be further broken down into its respective subroutines and functions.

Force fields are used to describe the interactions between atoms and molecules. The force field parameters are determined by fitting the parameters of a mathematical equation to the experimental data. This equation is then used to calculate the forces between the atoms, and the resulting structure is used to describe the behavior of the molecules. The force fields are also used to calculate the energies of the molecules in their various states.

The subrudder library contains a set of subroutines that perform various calculations. These subroutines can be divided into three categories: the force Field subroutines, the analysis subroutines, and the visualization/output subroutines. The force Field subroutines include routines that calculate the energy and forces between various atoms and molecules, as well as routines that calculate the equilibrium structure of the system. The analysis subroutines are used to analyze the results of the calculations, while the visualization/output subroutines are used to produce graphs and charts for detailed analysis.

AMBER is an advanced program used in a variety of fields for molecular dynamics, modeling, and analysis. Its wide range of features and functions makes it an essential tool for the computational scientists and researchers. It is widely used in the pharmaceutical industry, chemical engineering, and atomic physics. AMBER allows scientists to quickly and accurately simulate and analyze the behavior of molecules and atoms, giving them insight into chemical and physical processes.

The specific data is subject to PDF, and the above content is for reference