[gmx-users] erfc

[Erik Lindahl]

In the inner loops it is tabulated with cubic spline interpolation.

Cheers,

Erik

On Wednesday, Apr 2, 2003, at 08:44 US/Pacific, Lianqing Zheng wrote:

> Dear Gromacs pals:
>
> How does Gromacs deal with erfc(), using the one in C or an  
> approximation?
> Thanks!
>
> Lianqing
>
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------------------------------------------------------------------------ 
-----
Erik Lindahl, MSc, PhD     <lindahl at stanford.edu>
D109, Fairchild Building
Dept. Structural Biology, Stanford University School of Medicine
Tel. 650-7250754    Fax. 650-7238464