<?xml version='1.0' encoding='ASCII'?>
<ccp4i2>
  <ccp4i2_header>
    <function>DEF</function>
    <comment/>
    <userId>lizp</userId>
    <creationTime>12:37 07/Sep/11</creationTime>
    <pluginVersion></pluginVersion>
    <ccp4iVersion>0.0.1</ccp4iVersion>
    <project/>
    <pluginName>molrep_mr</pluginName>
    <pluginTitle>MR using Molrep</pluginTitle>
    <jobId/>
  </ccp4i2_header>
  <ccp4i2_body id="molrep_mr">
    <container id="inputData">
      <content id="F_SIGF">
        <className>CObsDataFile</className>
        <qualifiers>
          <mustExist>True</mustExist>
          <allowUndefined>False</allowUndefined>
          <fromPreviousJob>True</fromPreviousJob>
          <requiredContentFlag>4</requiredContentFlag>
        </qualifiers>
      </content>
      <content id="F_PHI_MAP">
        <className>CMapCoeffsDataFile</className>
        <qualifiers>
          <mustExist>True</mustExist>
          <allowUndefined>True</allowUndefined>
          <fromPreviousJob>True</fromPreviousJob>
        </qualifiers>
      </content>
      <content id="SEQIN">
        <className>CSeqDataFile</className>
        <qualifiers>
          <mustExist>True</mustExist>
          <allowUndefined>True</allowUndefined>
          <fromPreviousJob>False</fromPreviousJob>
        </qualifiers>
      </content>
      <content id="XYZIN">
        <className>CPdbDataFile</className>
        <qualifiers>
          <mustExist>True</mustExist>
          <allowUndefined>False</allowUndefined>
          <fromPreviousJob>True</fromPreviousJob>
	  <saveToDb>True</saveToDb>
	  <ifAtomSelection>True</ifAtomSelection>
	  <requiredSubType>2,1,0</requiredSubType>
          <default><subType>2</subType></default>
        </qualifiers>
      </content>
      <content id="SEQIN_2">
        <className>CSeqDataFile</className>
        <qualifiers>
          <mustExist>True</mustExist>
          <allowUndefined>True</allowUndefined>
          <fromPreviousJob>False</fromPreviousJob>
        </qualifiers>
      </content>
      <content id="XYZIN_2">
        <className>CPdbDataFile</className>
        <qualifiers>
          <mustExist>True</mustExist>
          <allowUndefined>True</allowUndefined>
          <fromPreviousJob>False</fromPreviousJob>
	  <saveToDb>False</saveToDb>
	  <requiredSubType>2,1,0</requiredSubType>
	  <default><subType>2</subType></default>
        </qualifiers>
      </content>
      <content id="XYZIN_FIX">
        <className>CPdbDataFile</className>
        <qualifiers>
          <mustExist>True</mustExist>
          <allowUndefined>True</allowUndefined>
          <fromPreviousJob>False</fromPreviousJob>
	  <requiredSubType>1,0</requiredSubType>
	  <default><subType>1</subType></default>
        </qualifiers>
      </content>
    </container>
    <container id="outputData">
      <content id="XYZOUT">
        <className>CPdbDataFile</className>
        <qualifiers>
          <mustExist>False</mustExist>
	  <default><subType>1</subType></default>
	  <subType>1</subType>
        </qualifiers>
      </content>
      <content id="XMLOUT">
        <className>CXmlDataFile</className>
        <qualifiers>
          <mustExist>False</mustExist>
        </qualifiers>
      </content>
    </container>
    <container id="controlParameters">
      <content id="PRF">
        <className>CString</className>
        <qualifiers>
          <default>n</default>
          <onlyEnumerators>True</onlyEnumerators>
          <enumerators>n,y,s</enumerators>
          <toolTip>Try all</toolTip>
        </qualifiers>
      </content>
      <content id="NP">
        <className>CString</className>
        <qualifiers>
          <default>Auto</default>
          <enumerators>Auto,10,20,30,50,100,200</enumerators>
          <onlyEnumerators>True</onlyEnumerators>
        </qualifiers>
      </content>
      <content id="NPT">
        <className>CString</className>
        <qualifiers>
          <default>Auto</default>
          <enumerators>Auto,10,20,30,50,100</enumerators>
          <onlyEnumerators>True</onlyEnumerators>
        </qualifiers>
      </content>
      <content id="NMON">
        <className>CString</className>
        <qualifiers>
          <default>Auto</default>
          <enumerators>Auto,1,2,3,4,5,6,7,8,9,10,11,12</enumerators>
          <onlyEnumerators>True</onlyEnumerators>
        </qualifiers>
      </content>
      <content id="SCORE">
        <className>CString</className>
        <qualifiers>
          <default>y</default>
          <onlyEnumerators>True</onlyEnumerators>
          <enumerators>y,n,c</enumerators>
          <toolTip>Scoring andstopping rules</toolTip>
        </qualifiers>
      </content>
      <content id="ANISO">
        <className>CString</className>
        <qualifiers>
          <onlyEnumerators>True</onlyEnumerators>
          <enumerators>y,n,k</enumerators>
          <default>y</default>
        </qualifiers>
      </content>
      <content id="SEQ">
        <className>CString</className>
        <qualifiers>
          <default>y</default>
          <onlyEnumerators>True</onlyEnumerators>
          <enumerators>y,d,n</enumerators>
          <toolTip>Try all</toolTip>
        </qualifiers>
      </content>
      <content id="SURF">
        <className>CString</className>
        <qualifiers>
          <default>y</default>
          <onlyEnumerators>True</onlyEnumerators>
          <enumerators>y,c,n,2,a</enumerators>
          <toolTip>Try all</toolTip>
        </qualifiers>
      </content>
      <content id="NMON_EXP">
        <className>CString</className>
        <qualifiers>
          <default>Auto</default>
          <enumerators>Auto,1,2,3,4,5,6,7,8,9,10,11,12</enumerators>
        </qualifiers>
      </content>
      <content id="SIM">
        <className>CFloat</className>
        <qualifiers>
          <min>0.0</min>
          <max>1.0</max>
          <default>0.5</default>
        </qualifiers>
      </content>
      <content id="RESMAX">
        <className>CFloat</className>
        <qualifiers>
          <min>0.0</min>
        </qualifiers>
      </content>
      <content id="BADD">
        <className>CFloat</className>
        <qualifiers>
          <min>0.0</min>
          <max>100.0</max>
          <default>0.0</default>
        </qualifiers>
      </content>
      <content id="RESMIN">
        <className>CFloat</className>
        <qualifiers>
          <min>0.0</min>
        </qualifiers>
      </content>
      <content id="BOFF">
        <className>CFloat</className>
        <qualifiers>
          <min>0.0</min>
          <max>100.0</max>
          <default>0.0</default>
        </qualifiers>
      </content>
      <content id="HIGH_PATH_VAR">
        <className>CString</className>
        <qualifiers>
          <default>s</default>
          <onlyEnumerators>True</onlyEnumerators>
          <enumerators>s,i,r,b</enumerators>
        </qualifiers>
      </content>
      <content id="LOW_PATH_VAR">
        <className>CString</className>
        <qualifiers>
          <default>c</default>
          <onlyEnumerators>True</onlyEnumerators>
          <enumerators>c,r,b</enumerators>
        </qualifiers>
      </content>
      <content id="SG_OPTIONS">
        <className>CString</className>
        <qualifiers>
	  <default>no</default>
          <onlyEnumerators>True</onlyEnumerators>
          <enumerators>no,specify,laue</enumerators>
	  <menuText>as input reflection file,specify alternative,all space groups in Laue group of input reflection file</menuText>
        </qualifiers>
      </content>
      <content id="SG">
        <className>CSpaceGroup</className>
        <qualifiers>
          <allowUndefined>True</allowUndefined>
        </qualifiers>
      </content>
    </container>
    <container id="guiParameters">
      <content id="PERFORM">
        <className>CString</className>
        <qualifiers>
          <onlyEnumerators>True</onlyEnumerators>
          <enumerators>srf,pat,den</enumerators>
          <default>pat</default>
        </qualifiers>
      </content>
      <content id="OPEN_HIGH_PATH_VAR">
        <className>CBoolean</className>
        <qualifiers>
          <default>False</default>
        </qualifiers>
      </content>
    </container>
  </ccp4i2_body>
</ccp4i2>
