From 953e68fee762854e39fce674181526ee85c3b75e Mon Sep 17 00:00:00 2001
From: Anatoly <Titov_AI@pnpi.nrcki.ru>
Date: Wed, 21 Oct 2020 17:50:30 +0300
Subject: [PATCH] - debug

---
 src/colorvec.cpp | 4 +++-
 1 file changed, 3 insertions(+), 1 deletion(-)

diff --git a/src/colorvec.cpp b/src/colorvec.cpp
index a0857e6..1ee6d78 100644
--- a/src/colorvec.cpp
+++ b/src/colorvec.cpp
@@ -147,7 +147,7 @@ inline void RVecVecMultiply(gmx::RVec &n, const gmx::RVec &a, const gmx::RVec &b
 
 // поиск угла между двумя RVec'ами
 inline double RVecAngle(const gmx::RVec &a, const gmx::RVec &b) {
-    return std::acos((a[0] * b[0] + a[1] * b[1] + a[2] * b[2]) / (a.norm() * b.norm()));
+    return std::acos((a[0] * b[0] + a[1] * b[1] + a[2] * b[2]) / (a.norm() * b.norm())) * 180.0 / 3.14159265;
 }
 
 // вычисление внутренних углов в краске
@@ -266,6 +266,8 @@ inline void searchNearBetaLists(const std::vector< gmx::RVec > &inputFrame, cons
         for (size_t j = 0; j < inputBLists.size(); ++j) {
             for (size_t k = 0; k < inputBLists[j].size(); ++k) {
                 for (size_t m = 0; m < inputAminoacids[inputBLists[j][k]].size(); ++m) {
+                    std::cout << inputFrame[inputAminoacids[inputBLists[j][k]][m]][0] << " " << inputFrame[inputAminoacids[inputBLists[j][k]][m]][1] << " " <<
+                              inputFrame[inputAminoacids[inputBLists[j][k]][m]][2] << "\n";
                     if ((inputFrame[inputAminoacids[inputBLists[j][k]][m]] - inputFrame[inputColor[i].second]).norm() <= cutOff) {
                         outputList[j] = true;
                         std::cout << "yes";
-- 
2.22.0