Spectral Simulation Study on the Influence of the Principal Component Analysis Step on Principal Component Regression

2006 ◽  
Vol 60 (1) ◽  
pp. 95-98 ◽  
Author(s):  
Takeshi Hasegawa
1999 ◽  
Vol 32 (15) ◽  
pp. 3131-3141 ◽  
Author(s):  
Stella Vaira ◽  
Víctor. E. Mantovani ◽  
Juan C. Robles ◽  
Juan C. Sanchis ◽  
Héctor C. Goicoechea

2018 ◽  
Vol 1 (1) ◽  
pp. 60
Author(s):  
Didi Nurhadi

ABSTRAK Hubungan Kuantitatif Struktur dan Aktivitas (HKSA) pada suatu seri senyawa turunan kurkumin telah dikaji dengan menggunakan data muatan bersih atom hasil perhitungan semi empirik AM1 dengan pendekatan Principal Component Regression PCR. Pengkajian dilakukan terhadap data aktivitas antiinflamasi yang menghambat lipoksigenase (log (1/IC50)) sebagai fungsi linear dan variable laten (Tx) hasil transformasi data muatan bersih atom menggunakan Principal Component Analysis (PCA). Persamaan HKSA ditentukan berdasar kontribusi komponen yang terpilih dan selanjutnya dianalisis dengan pendekatan Model persamaan HKSA yang diperoleh adalah: log (1/IC50) = -0,669-1,816.T1+1,697.T2 –3,643.T3 Persamaan tersebut mempunyai tingkat kepercayaan 95 % dengan parameter statistik n =9,  r2 = 0.700,  SE = 0,355, Fhitung/Ftabel=1,19 dan PRESS = 0,082.  Kata kunci : HKSA, kurkumin, lipoksigenase, PCA, muatan bersih atom


2017 ◽  
Vol 84 (1) ◽  
Author(s):  
Johannes Kiefer ◽  
Andreas Bösmann ◽  
Peter Wasserscheid

AbstractIn the past two decades, ionic liquids have found many applications as solvents for complex solutes. Prominent examples are the dissolution of biomass and carbohydrates as well as catalytically active substances. The chemical analysis of such solutions, however, is still a challenge due to the molecular complexity. In the present work, the use of infrared spectroscopy for quantifying the concentration of different solutes dissolved in an imidazolium-based ionic liquid is investigated. Binary solutions of glucose, cellubiose, and Wilkinson's catalyst in 1-ethyl-3-methylimidazolium acetate are studied as examples. For this purpose, different chemometric approaches (principal component analysis (PCA), partial least-squares regression (PLSR), and principal component regression (PCR)) for analyzing the spectra are tested. Principal component analysis was found to be suitable for classifying the different solutions. Both regression techniques were capable of deriving accurate concentration values. The performance of PLSR was slightly better than that of PCR for the same number of components.


2014 ◽  
Vol 711 ◽  
pp. 231-234
Author(s):  
Zheng Zhu Zhou ◽  
Xiao Yi Jin ◽  
Xiang Wei Zhang ◽  
Yu Yi Lin

Based on MMW-1A vertical multifunctional friction and wear tester for the study,taking steel 45 as the research object, randomly changing the experiment load, speed, sliding distance and the size of the contact area, then the data we collect are processed and analyzed by principal component analysis, and obtained linear regression models by principal component regression, regression model has been tested with good fitting effect. The results showed that the principal component analysis method is also suitable for experimental study of friction and wear, explore new methods in the analysis of tribology. It shows that load, speed and sliding distance have a weakening effect on the friction coefficient, on the contrary, the contact area has a promoting role to the friction coefficient.


Robotica ◽  
2009 ◽  
Vol 27 (2) ◽  
pp. 249-257 ◽  
Author(s):  
J. G. Daniël Karssen ◽  
Martijn Wisse

SUMMARYLarge disturbances can cause a biped to fall. If an upcoming fall can be detected, damage can be minimized or the fall can be prevented. We introduce the multi-way principal component analysis (MPCA) method for the detection of upcoming falls. We study the detection capability of the MPCA method in a simulation study with the simplest walking model. The results of this study show that the MPCA method is able to predict a fall up to four steps in advance in the case of single disturbances. In the case of random disturbances the MPCA method has a successful detection probability of up to 90%.


2013 ◽  
Vol 663 ◽  
pp. 982-987
Author(s):  
Hong Lian Li ◽  
Yong Jie Wei ◽  
Wen Liang Chen

Differential optical absorption spectroscopy (DOAS) is a well-established and widely used technique for monitoring atmospheric pollution. The month performance of a DOAS system was assessed at a certain place in Tianjin University, China, where is farther away from the industrial pollution a source. Three methods were used to inverse the hourly concentrations of nitrogen dioxide (NO2), sulfur dioxide (SO2), ozone (O3). Principal component analysis (PCA) was performed to analyze the retrieving concentrations. Results were obtained for estimated temporal NO, NO2, SO2, O3 distributions over the urban atmosphere; demonstrating the capability of the principal component analysis applied in differential optical absorption spectroscopy (PCA-DOAS) technique.


2020 ◽  
Vol 38 (4) ◽  
pp. 1178-1193
Author(s):  
Wan Li ◽  
Tongjun Chen ◽  
Xiong Song ◽  
Tianqi Gong ◽  
Mengyue Liu

Wireline logging plays a critical role in coalbed methane exploration. However, the lack of crucial log data, such as neutron and sonic logs, makes coalbed methane exploration difficult. In this paper, we propose a principal component regression model incorporating a multiscale wavelet analysis, a histogram calibration, a principal component analysis, and a multivariate regression to reconstruct essential neutron and sonic logs from conventional logs (i.e., density, resistivity, gamma ray, spontaneous potential, and caliper logs). Our proposed model does not need core-related correlation, and there is no local optimization. We have applied the model to evaluate coalbed methane content in a real case. Firstly, we use the multiscale wavelet analysis and histogram calibration to improve logs’ reliability and lateral comparability. Then, we apply principal component analysis to transform the well-correlated wireline logs into linearly independent components and regress reconstruction functions for neutron and sonic logs with multivariate regression. The reconstructed logs are like the measured logs in trend, mean, and scale. Finally, we apply the reconstructed neutron logs to predict the coalbed methane-content distribution. The predicted distribution is not only following the regional distribution characteristics of coalbed methane enrichment zones but also validated by the coalbed methane production data. In summary, the successful applications of wireline-log reconstruction and regional coalbed methane-content prediction have demonstrated the reliability of the proposed principal component regression model.


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