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Karplus equation
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Karplus equation
2026-10-20
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A
Karplus equation
relates
a
vicinal
scalar
coupling
to molecular torsion, often represented
as
J
=
A
cos
2
ϕ
+
B
cos
ϕ
+
C
.
Parameters
depend on the chemical environment.
A
mobile
molecule
gives
a
population
average
of
couplings
, which is generally not the
coupling
evaluated at its
mean
angle
.
Total
articles
:
1