pygromos.tests.test_analysis package¶

Submodules¶

pygromos.tests.test_analysis.test_error_estimate module¶

class pygromos.tests.test_analysis.test_error_estimate.test_ee(methodName='runTest')[source]¶

Bases: unittest.case.TestCase

error_estimate_class¶: alias of pygromos.analysis.error_estimate.error_estimator

test_array = array([ 0, 1, 2, ..., 9997, 9998, 9999])¶

test_constructor()[source]¶

test_error_estimate()[source]¶

pygromos.tests.test_analysis.test_freeEnergy module¶

class pygromos.tests.test_analysis.test_freeEnergy.test_BAR(methodName='runTest')[source]¶

Bases: pygromos.tests.test_analysis.test_freeEnergy.test_ZwanzigEquation

feCalculation¶: alias of pygromos.analysis.free_energy_calculation.bennetAcceptanceRatio

test_free_Energy1()[source]¶

class pygromos.tests.test_analysis.test_freeEnergy.test_ZwanzigEquation(methodName='runTest')[source]¶

Bases: unittest.case.TestCase

feCalculation¶: alias of pygromos.analysis.free_energy_calculation.zwanzigEquation

test_constructor()[source]¶

test_free_Energy1()[source]¶

class pygromos.tests.test_analysis.test_freeEnergy.test_threeStateZwanzigReweighting(methodName='runTest')[source]¶

Bases: pygromos.tests.test_analysis.test_freeEnergy.test_ZwanzigEquation

feCalculation¶: alias of pygromos.analysis.free_energy_calculation.threeStateZwanzig

test_free_Energy1()[source]¶

Module contents¶