diff options
Diffstat (limited to 'academic/wxmacmolplt/wxmacmolplt-7.2.1-raman.patch')
| -rw-r--r-- | academic/wxmacmolplt/wxmacmolplt-7.2.1-raman.patch | 33 |
1 files changed, 0 insertions, 33 deletions
diff --git a/academic/wxmacmolplt/wxmacmolplt-7.2.1-raman.patch b/academic/wxmacmolplt/wxmacmolplt-7.2.1-raman.patch deleted file mode 100644 index 6845b0bdaa..0000000000 --- a/academic/wxmacmolplt/wxmacmolplt-7.2.1-raman.patch +++ /dev/null @@ -1,33 +0,0 @@ -diff -Nru wxmacmolplt-7.2.1.orig/src/Frame.cpp wxmacmolplt-7.2.1/src/Frame.cpp ---- wxmacmolplt-7.2.1.orig/src/Frame.cpp 2008-04-10 01:04:51.000000000 +0400 -+++ wxmacmolplt-7.2.1/src/Frame.cpp 2009-03-09 10:59:11.000000000 +0300 -@@ -1896,6 +1896,29 @@ - } else tVib = icol; - } - } -+ if (Buffer->LocateKeyWord("RAMAN ACTIVITY:", 15, Buffer->GetFilePos()+132)) { -+ Buffer->GetLine(LineText); -+ LinePos = 16; -+ if ((imode == NumVibs)&&(lVibs->RamanIntensity.empty())) { -+ lVibs->RamanIntensity.reserve(NumModes); -+ } -+ LineLength = strlen(LineText); -+ long tVib = NumVibs; -+ float raman; -+ for (long icol=0; icol<tVib; icol++) { -+ if (LinePos<LineLength) { -+ test = sscanf(&(LineText[LinePos]), "%s%n", &token, &nchar); -+ LinePos += nchar; -+ if (test) { -+ if (token[0] != '*') { -+ test = sscanf(token, "%f", &raman); -+ if (test) -+ lVibs->RamanIntensity.push_back(raman); -+ } else lVibs->RamanIntensity.push_back(10000.0); -+ } else tVib = icol; -+ } else tVib = icol; -+ } -+ } - if (Buffer->LocateKeyWord("DEPOLARIZATION:", 15, Buffer->GetFilePos()+132)) { - Buffer->GetLine(LineText); - LinePos = 16; |