Ejemplo n.º 1
0
        public void RegressionTest()
        {
            var statPrecursorMzs = new Statistics(new[]
                {
                    458.740356,
                    533.294964,
                    623.29589,
                    471.256174,
                    509.751255,
                    490.245806,
                    506.774731,
                    487.281857,
                    500.731477,
                    713.317688,
                    621.298432,
                    499.272978,
                    530.270147,
                    869.449568,
                    482.266541,
                    540.290213,
                    692.868631,
                    634.355888,
                    582.318971,
                    653.361701
                });

            var statCEs = new Statistics(new[]
                {
                    17.911172,
                    18.446029,
                    25.50606,
                    17.33671,
                    23.645543,
                    18.982357,
                    19.544341,
                    17.881583,
                    18.33887,
                    24.566801,
                    22.438147,
                    17.289281,
                    23.343185,
                    29.875285,
                    17.711062,
                    18.683867,
                    23.871533,
                    22.8821,
                    20.112845,
                    25.528298
                });

            // Values for this CE optimization regression were verified in Excel
            Assert.AreEqual(statCEs.ATerm2(statPrecursorMzs), 0.029982, 0.000001);
            Assert.AreEqual(statCEs.BTerm2(statPrecursorMzs), 4.104255, 0.0000001);
            Assert.AreEqual(statCEs.StdErrATerm2(statPrecursorMzs), 0.003872, 0.000001);
            Assert.AreEqual(statCEs.StdErrBTerm2(statPrecursorMzs), 2.241899, 0.000001);
        }