From: Max <Infinity2573@gmail.com>
Date: Mon, 19 Sep 2022 22:35:04 +0000 (+0300)
Subject: asdsad
X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=commitdiff_plain;h=521b9b502401f7d94b64498a5a90c927deb718c9;p=alexxy%2Fgromacs-dssp.git

asdsad
---

diff --git a/src/dssptools.cpp b/src/dssptools.cpp
index 1b9aec6..beac203 100644
--- a/src/dssptools.cpp
+++ b/src/dssptools.cpp
@@ -151,11 +151,10 @@ bool secondaryStructures::NoChainBreaksBetween(std::size_t Resi1, std::size_t Re
     }
 
     for (; i != j; ++i){
-        if ( !(SecondaryStructuresStatusMap[i].isBreakPartnerWith(&SecondaryStructuresStatusMap[i + 1]) && SecondaryStructuresStatusMap[i + 1].isBreakPartnerWith(&SecondaryStructuresStatusMap[i])) ){
-
+        if ( SecondaryStructuresStatusMap[i].isBreakPartnerWith(&SecondaryStructuresStatusMap[i + 1]) && SecondaryStructuresStatusMap[i + 1].isBreakPartnerWith(&SecondaryStructuresStatusMap[i]) ){
+            std::cout << "Patternsearch has detected a CHAINBREAK between " << Resi1 << " and " << Resi2 << std::endl;
+            return false;
         }
-        std::cout << "Patternsearch has detected a CHAINBREAK between " << Resi1 << " and " << Resi2 << std::endl;
-        return false;
     }
     return true;
 }