Expand this Topic clickable element to expand a topic
Skip to content
Optica Publishing Group
  • Applied Spectroscopy
  • Vol. 27,
  • Issue 3,
  • pp. 225-232
  • (1973)

Improved Discriminant Training and Feature Extraction for the Generation of Simulated Mass Spectra of Small Organic Molecules

Not Accessible

Your library or personal account may give you access

Abstract

An empirical method employing computerized pattern recognition techniques has been applied previously to the generation of simulated mass spectra of small organic molecules. The techniques have been improved in two ways to yield superior performance. First, a method for training adaptive binary pattern classifiers using an iterative least squares approach is used. Second, a feature extraction technique known as an attribute inclusion algorithm is used to investigate the importance of multiple features in the molecular descriptions.

PDF Article
More Like This
Highly discriminative and adaptive feature extraction method based on NMF–MFCC for event recognition of Φ-OTDR

Yi Huang, Jingyi Dai, Wei Shen, Xiaofeng Chen, Chengyong Hu, Chuanlu Deng, Lin Chen, Xiaobei Zhang, Wei Jin, Jianming Tang, and Tingyun Wang
Appl. Opt. 62(35) 9326-9333 (2023)

Optical neural network using vector-feature extraction

Yasunori Kuratomi, Akio Takimoto, Koji Akiyama, and Hisahito Ogawa
Appl. Opt. 32(29) 5750-5758 (1993)

Small-sample stacking model for qualitative analysis of aluminum alloys based on femtosecond laser-induced breakdown spectroscopy

Qing Ma, Ziyuan Liu, Tong Sun, Xun Gao, and YuJia Dai
Opt. Express 31(17) 27633-27653 (2023)

Cited By

You do not have subscription access to this journal. Cited by links are available to subscribers only. You may subscribe either as an Optica member, or as an authorized user of your institution.

Contact your librarian or system administrator
or
Login to access Optica Member Subscription

Select as filters


Select Topics Cancel
© Copyright 2024 | Optica Publishing Group. All rights reserved, including rights for text and data mining and training of artificial technologies or similar technologies.