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Re: [modeller_usage] Ca-Ca restraints



On 4/20/20 1:31 AM, Mariana GONZALEZ MEDINA wrote:
I understand now, I was only taking into account Ca-Ca distances for which the mathematical from was a Gaussian but if I use multiple templates the restraint becomes multimodal and the from is a spline. If I were to plot the distances with a gaussian from I would be plotting the probability density and the distance values. What are the values that I get for the spline?

It is exactly the same for a multimodal restraint - it is a probability density on the distance. A cubic spline is used because it is faster to evaluate than multiple Gaussians.

	Ben Webb, Modeller Caretaker
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