https://github.com/lhm30/PIDGIN
Tip revision: 809f36036fdefc3a718b6e83d76ef0ed82e43bd2 authored by lhm30 on 15 June 2017, 16:35:32 UTC
link to pidginv2
link to pidginv2
Tip revision: 809f360
StandMoleProt.xml
<?xml version="1.0" encoding="UTF-8"?>
<!--This file is created with ChemAxon's Configuration Builder-->
<!--This is a configuration file for ChemAxon's Standardizer-->
<StandardizerConfiguration>
<Actions>
<Removal ID="RemoveFragment" Method="keepLargest" Measure="atomCount"/>
<Neutralize ID="Neutralize"/>
<RemoveExplicitH ID="RemoveExplicitH" Lonely="true" Charged="true" Mapped="true" Isotopic="true" Radical="true" Wedged="true" Hconnected="true" Polymerendgroup="true" Sgroupend="true" Sgroup="true" Valenceerror="true" Bridgehead="true"/>
<Clean ID="Clean2D" Dim="2" Type="RemoveZCoordinate"/>
<Mesomerize ID="Mesomerize"/>
<Tautomerize ID="Tautomerize"/>
</Actions>
</StandardizerConfiguration>