AMBER Archive (2006)

Subject: AMBER: PhosphoThreonine Parms for use with ff03

From: Zu Thur Yew (yewzt_at_intern.bii-sg.org)
Date: Tue Jul 18 2006 - 00:19:15 CDT

Hi,

I would like ask if there are any pTHR parameters suitable for use with
ff03?

I know there are parms developed in the same way as ff94/ff99...the
charges for normal THR in ff99 & ff03 seems quite different...

has anyone any experience using these parms with ff03? Would problems be
expected if these parameters are used with ff03?

Any advice would be most appreciated!

Many Thanks,

ZT

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