Question Colvar o tclforces

Date: Sat Dec 12 2020 - 13:15:23 CST

Dear users namd,

I am doing the pulling of a water molecule, in the direction of -Z axis, however for some reason it goes up in + z, how could I put a force on it in such a way that it does not go to + Z and stays e the starting position and just go to -Z? , could you do this with tclforces or colvar?



Enviado desde mi iPhone

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