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    4bb2fb1c
    Added virtual method update() to Action · 4bb2fb1c
    Giovanni Bussi authored
    Small change in the mani flow. Now, after the backward loop to apply
    forces, there is another forward loop calling "update()". update() should
    be used to dump/analyse data, and/or to modify a biasing potential
    (e.g. in metadynamics or tamd). Also, since it is called after full
    calculation, analysis tools could access to more quantities (e.g.: forces
    on a specific CV have been already computed and could be dumped).
    4bb2fb1c
    History
    Added virtual method update() to Action
    Giovanni Bussi authored
    Small change in the mani flow. Now, after the backward loop to apply
    forces, there is another forward loop calling "update()". update() should
    be used to dump/analyse data, and/or to modify a biasing potential
    (e.g. in metadynamics or tamd). Also, since it is called after full
    calculation, analysis tools could access to more quantities (e.g.: forces
    on a specific CV have been already computed and could be dumped).
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