fix trp man conformation issue in webapp glycan plot

glycojones · Jan 9, 2024 · 52f3f95 · 52f3f95
1 parent 03e14f2
commit 52f3f95
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Showing 3 changed files with 6 additions and 3 deletions.
diff --git a/src/privateer/cpp/privateer-lib.cpp b/src/privateer/cpp/privateer-lib.cpp
@@ -2468,7 +2468,7 @@ void privateer::glycanbuilderplot::Plot::recursive_paint ( clipper::MGlycan mg,
     bool node_contains_issue_with_sugar = false;
     int branches = node.number_of_connections();
 
-    node_contains_issue_with_sugar = sugar_contains_issues(sugar);
+    node_contains_issue_with_sugar = sugar_contains_issues(sugar,mg);
 
 
     if ( sugname == "Glc" )

diff --git a/src/privateer/cpp/privateer-lib.h b/src/privateer/cpp/privateer-lib.h
@@ -174,9 +174,12 @@ namespace privateer
             return err;
         };
 
-        inline const bool sugar_contains_issues ( clipper::MSugar sugar )
+        inline const bool sugar_contains_issues ( clipper::MSugar sugar, clipper::MGlycan glycan )
         {
-
+            if ( ( glycan.get_type() == "c-glycan" ) && (sugar.type().trim() == "MAN" ) && (sugar.conformation_name() == "1c4"))
+                {
+                    sugar.override_conformation_diag ( true );
+                }
             if ( sugar.ok_with_conformation() && sugar.ok_with_anomer() &&
                     sugar.ok_with_chirality() && sugar.ok_with_puckering() )
                 return false;

diff --git a/webapp/src/wasm/privateer.wasm b/webapp/src/wasm/privateer.wasm