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- resind starts from 0
author
Anatoly
<Titov_AI@pnpi.nrcki.ru>
Wed, 21 Oct 2020 11:37:43 +0000
(14:37 +0300)
committer
Anatoly
<Titov_AI@pnpi.nrcki.ru>
Wed, 21 Oct 2020 11:37:43 +0000
(14:37 +0300)
src/colorvec.cpp
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diff --git
a/src/colorvec.cpp
b/src/colorvec.cpp
index b440569d960222331c57378f1aa62bc0d1f4564b..931b8e6157cfd0931357a85c70bc9077b0297c24 100644
(file)
--- a/
src/colorvec.cpp
+++ b/
src/colorvec.cpp
@@
-132,7
+132,7
@@
inline void aminoacidsIndexation(const std::vector< size_t > &inputIndex, const
aminoacidsIndex.resize(0);
for (size_t i = 0; i < inputIndex.size(); ++i) {
std::cout << top.atoms()->atom[inputIndex[i]].resind << std::endl;
aminoacidsIndex.resize(0);
for (size_t i = 0; i < inputIndex.size(); ++i) {
std::cout << top.atoms()->atom[inputIndex[i]].resind << std::endl;
- aminoacidsIndex.resize(std::max(aminoacidsIndex.size(), static_cast< size_t >(top.atoms()->atom[inputIndex[i]].resind)));
+ aminoacidsIndex.resize(std::max(aminoacidsIndex.size(), static_cast< size_t >(top.atoms()->atom[inputIndex[i]].resind
+ 1
)));
aminoacidsIndex[top.atoms()->atom[inputIndex[i]].resind - 1].push_back(inputIndex[i]);
}
}
aminoacidsIndex[top.atoms()->atom[inputIndex[i]].resind - 1].push_back(inputIndex[i]);
}
}