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Updated user guide for carb chains
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jdickerson95 committed Aug 14, 2018
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Expand Up @@ -439,6 +439,19 @@ \subsection{\Keyword{NUMDNA}}
The default value for \textit{I} is 0.


\subsection{\Keyword{NUMCARB}}
\label{numcarb}
\RDLegacyKeyword

\noindent \Keyword{NUMCARB \textit{I}}

specifies the number of carbohydrate residues per monomer. Only integer numbers \textit{I} should be used. Using this keyword the number and types of atoms are calculated assuming an average carbohydrate content defined as
\[ \mbox{mean sugar} = 11H + 6C + 5O \]
If a more accurate estimate is required, individual atoms may be entered explicitly with \hyperref[proteinheavyatoms]{the \Keyword{PROTEINHEAVYATOMS} keyword}.

The default value for \textit{I} is 0.


\subsection{\Keyword{PROTEINHEAVYATOMS}}
\label{proteinheavyatoms}
\RDLegacyKeyword
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