Molecular mechanics (MM4) calculations on alkenes.

Neysa Nevins Kuo-Hsiang Chen Norman L. Allinger

Published in: J. Comput. Chem. (1996)

Keyphrases

average error
rms error
dna computing
molecular structure
root mean square
data sets
neural network
computer vision
three dimensional
clinical setting
van der waals
database
molecular dynamics simulations
registration errors
multiscale
image sequences
case study
image processing
machine learning