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Screened Coulomb Potentials Implicit Solvent Model : ウィキペディア英語版 | Screened Coulomb Potentials Implicit Solvent Model
SCP-ISM, or Screened Coulomb Potentials Implicit Solvent Model is a continuum approximation of solvent effects for use in computer simulations of biological macromolecules, such as proteins and nucleic acids, usually within the framework of molecular dynamics. It is based on the classic theory of polar liquids, as developed by Peter Debye and corrected by Lars Onsager to incorporate reaction field effects. The model can be combined with quantum chemical calculations to formally derive a continuum model of solvent effects suitable for computer simulations of small and large molecular systems. == External links ==
* (An essay on SCP-ISM ) * (CHARMM website )
抄文引用元・出典: フリー百科事典『 ウィキペディア(Wikipedia)』 ■ウィキペディアで「Screened Coulomb Potentials Implicit Solvent Model」の詳細全文を読む
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