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author
Max
<Infinity2573@gmail.com>
Sun, 25 Sep 2022 13:21:24 +0000
(16:21 +0300)
committer
Max
<Infinity2573@gmail.com>
Sun, 25 Sep 2022 13:21:24 +0000
(16:21 +0300)
src/dssptools.cpp
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diff --git
a/src/dssptools.cpp
b/src/dssptools.cpp
index 86efd54a05aa19b8ee6581858edd382601739672..0dc84e871951c3ec750920daa1b43d460dfe9413 100644
(file)
--- a/
src/dssptools.cpp
+++ b/
src/dssptools.cpp
@@
-709,6
+709,8
@@
void DsspTool::calculateHBondEnergy(ResInfo& Donor,
}
}
+ std::cout << "For Donor №" << Donor.info->nr << " and accpetor №" << Acceptor.info->nr << std::endl;
+
std::cout << "CA-CA distance: " << CalculateAtomicDistances(
Donor.getIndex(backboneAtomTypes::AtomCA), Acceptor.getIndex(backboneAtomTypes::AtomCA), fr, pbc) << std::endl;
std::cout << "N-O distance: " << distanceNO << std::endl;