diff --git a/pydnmr/dnmrmath.py b/pydnmr/dnmrmath.py index 135e872..d61af9d 100644 --- a/pydnmr/dnmrmath.py +++ b/pydnmr/dnmrmath.py @@ -121,8 +121,7 @@ def two_spin(v, va, vb, ka, wa, wb, pa): R = 2 * pi * Dv * (1 + tau * ((1 / T2a) + (1 / T2b))) R += pi * dv * tau * ((1 / T2b) - (1 / T2a)) + pi * dv * (pa - pb) - I = (P * (1 + tau * ((pb / T2a) + (pa / T2b))) + Q * R) / (P ** 2 + R ** 2) - return I + return (P * (1 + tau * ((pb / T2a) + (pa / T2b))) + Q * R) / (P ** 2 + R ** 2) def d2s_func(va, vb, ka, wa, wb, pa): @@ -241,5 +240,4 @@ def dnmr_AB(v, v1, v2, J, k, w): n2 = r_minus * b_minus - s * a_minus d2 = a_minus ** 2 + b_minus ** 2 - I = (n1 / d1) + (n2 / d2) - return I + return (n1 / d1) + (n2 / d2) diff --git a/tests/test_main.py b/tests/test_main.py index 6b3ff4e..76f4bca 100644 --- a/tests/test_main.py +++ b/tests/test_main.py @@ -147,16 +147,13 @@ def test_find_two_singlets_widget(self): def test_find_two_singlets_layout(self): foundLayout = self.ui.findChild(QGridLayout, 'twosingletslayout') - if foundLayout: - print('Found layout named', foundLayout.objectName()) - print('Found layout has parent:', foundLayout.parent(), - foundLayout.parent().objectName()) - else: + if not foundLayout: foundLayout = self.ui.centralWidget().layout() print('Did not find QGridLayout child named "twosingletlayout"') - print('Found layout named', foundLayout.objectName()) - print('Found layout has parent:', foundLayout.parent(), - foundLayout.parent().objectName()) + + print('Found layout named', foundLayout.objectName()) + print('Found layout has parent:', foundLayout.parent(), + foundLayout.parent().objectName()) def test_find_AB_widget(self): foundABWidget = self.ui.findChild(QWidget, 'abwidget') @@ -361,7 +358,7 @@ def test_twiddle_buttons(self): for widget in main.ab_vars: print(widget.value, 'vs. ', self.widgetdict[widget.key].value()) - if widget.key == 'k_ab' or widget.key == 'wa': + if widget.key in ['k_ab', 'wa']: assert self.widgetdict[widget.key].value() == 20.01 # k and wa widgets should not go below 0.01 elif widget.key == 'j_ab':