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<TITLE>Question about restraints</TITLE>
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<P DIR=LTR><SPAN LANG="en-us"><FONT FACE="Calibri">Hi,</FONT></SPAN></P>
<P DIR=LTR><SPAN LANG="en-us"><FONT FACE="Calibri">I was wondering</FONT></SPAN><SPAN LANG="en-us"> <FONT FACE="Calibri">what the</FONT></SPAN><SPAN LANG="en-us"> <FONT FACE="Calibri">def</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri">au</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri">lt values for restraints in</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri"> reel/elbow represent in terms of</FONT></SPAN><SPAN LANG="en-us"> <FONT FACE="Calibri">‘</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri">tightness</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri">’</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri"> for lack of a better word.</FONT></SPAN></P>
<P DIR=LTR><SPAN LANG="en-us"><FONT FACE="Calibri">I am trying to tighten up the geometry of a badly behaving ligand and want to avoid</FONT></SPAN><SPAN LANG="en-us"> <FONT FACE="Calibri">over tightening</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri">.</FONT></SPAN><SPAN LANG="en-us"> <FONT FACE="Calibri">What is the consensus out there what kind of ESDs represent a</FONT></SPAN><SPAN LANG="en-us"> <FONT FACE="Calibri">‘</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri">loose</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri">’</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri"></FONT></SPAN><SPAN LANG="en-us"> <FONT FACE="Calibri">‘</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri">medium</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri">’</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri"> and</FONT></SPAN><SPAN LANG="en-us"> <FONT FACE="Calibri">‘</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri">tight</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri">’</FONT></SPAN><SPAN LANG="en-us"><FONT FACE="Calibri"> restraint for bond, angle, dihedral, planar and chiral restraints.</FONT></SPAN><SPAN LANG="en-us"></SPAN></P>
<P DIR=LTR><SPAN LANG="en-us"><FONT FACE="Calibri">Thanks</FONT></SPAN></P>
<P DIR=LTR><SPAN LANG="en-us"> <FONT FACE="Calibri">Carsten</FONT></SPAN></P>
<P DIR=LTR><SPAN LANG="en-us"></SPAN></P>
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