Editing SHAKE
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'''SHAKE''' is an algorithm designed for [[molecular dynamics]] simulation of systems with constraints (e.g. fixed bond-lengths). | '''SHAKE''' is an algorithm designed for [[molecular dynamics]] simulation of systems with constraints (e.g. fixed bond-lengths). | ||
The constraints are satisfied (almost by construction of the algorithm) at each simulation | The constraints are satisfied (almost by construction of the algorithm) at each simulation step. | ||
==Variants== | ==Variants== | ||
*[[M-SHAKE]] | *[[M-SHAKE]] |