From 7f328e7746eab21906959f408b430ed6d2cf668d Mon Sep 17 00:00:00 2001
From: arcan1s <darkarcanis@mail.ru>
Date: Sat, 6 Dec 2014 01:07:15 +0300
Subject: [PATCH] fix #1 some edit of python files

---
 mathmech/radf/src/main.c | 6 +++---
 xvg2csv/xvg2csv.py       | 6 +++---
 2 files changed, 6 insertions(+), 6 deletions(-)

diff --git a/mathmech/radf/src/main.c b/mathmech/radf/src/main.c
index 129cb7d..5460e96 100644
--- a/mathmech/radf/src/main.c
+++ b/mathmech/radf/src/main.c
@@ -248,12 +248,12 @@ int main(int argc, char *argv[])
   _atom_info = (atom_info *) malloc (8 * _system_info.num_atoms * sizeof (atom_info));
   if (mode == 2)
   {
-    i = (_radf_info.r_max - _radf_info.r_min) / _radf_info.r_step;
-    j = (_radf_info.ang_max - _radf_info.ang_min) / _radf_info.ang_step;
+    i = 1 + (_radf_info.r_max - _radf_info.r_min) / _radf_info.r_step;
+    j = 1 + (_radf_info.ang_max - _radf_info.ang_min) / _radf_info.ang_step;
     i *= j;
   }
   else
-    i = (_radf_info.r_max - _radf_info.r_min) / _radf_info.r_step;
+    i = 1 + (_radf_info.r_max - _radf_info.r_min) / _radf_info.r_step;
   radf = (int *) malloc (i * sizeof (int));
   for (j=0; j<i; j++)
     radf[j] = 0;
diff --git a/xvg2csv/xvg2csv.py b/xvg2csv/xvg2csv.py
index ce8e37f..c4f5d22 100755
--- a/xvg2csv/xvg2csv.py
+++ b/xvg2csv/xvg2csv.py
@@ -27,7 +27,7 @@ def defineType(file):
             if (line[0] == '@') and (line.find("title") > -1):
                 if (line.find("RMSD") > -1):
                     type = "rmsd"
-                elif (line.find("distance") > -1):
+                elif (line.find("istance") > -1):
                     type = "dist"
                 elif (line.find("Angle") > -1):
                     type = "angl"
@@ -230,9 +230,9 @@ if __name__ == "__main__":
         help = 'Do not create *.csv file', action = 'store_true', default = False)
     parser.add_argument('-nq', '--noqti', dest = 'noqti',
         help = 'Do not create *.qti file', action = 'store_true', default = False)
-    parser.add_argument('-t', '--time', dest = 'time',
+    parser.add_argument('-t', '--time', dest = 'time', type = int,
         help = 'Averaging time', action = 'store', default = 1)
-    parser.add_argument('-s', '--step', dest = 'step',
+    parser.add_argument('-s', '--step', dest = 'step', type = float,
         help = 'Time step', action = 'store', default = 1.0)
     args = parser.parse_args()