A Different Method for Steric Field Evaluation in CoMFA Improves Model Robustness.
Traian SuleaTudor I. OpreaSorel MuresanShek Ling ChanPublished in: J. Chem. Inf. Comput. Sci. (1997)
Keyphrases
- evaluation method
- mathematical model
- evaluation model
- evaluation framework
- cost function
- probabilistic model
- statistical model
- theoretical analysis
- prior knowledge
- similarity measure
- detection method
- parameter estimation
- analytical model
- modeling method
- optimization model
- objective function
- hybrid model
- sensitivity analysis
- prior information
- markov model
- regression analysis
- significant improvement
- linear model
- study proposes
- classification method
- gold standard
- dynamic programming
- pairwise
- parameter space
- gaussian distribution
- hybrid method
- autoregressive
- network model
- comprehensive evaluation model
- preprocessing
- bayesian framework
- neural network model
- high order
- support vector machine
- test data
- energy function
- artificial neural networks
- high accuracy
- reconstruction method
- feature set
- input data
- model selection
- computational model
- bp neural network
- parametric models
- computational efficiency
- kalman filter
- linear regression