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Empirical methods for calculation of partial atomic charges – applicability for proteins?
Empirical methods for calculation of partial atomic charges – applicability for proteins?
2018
Tomáš Raček
Ondřej Schindler
Radka Svobodová Vařeková
Jaroslav Koča
Keywords:
Statistical physics
Parametrization
Empirical research
Mathematics
atomic charge
Physics
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