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Computer simulation of physical-chemical properties of organic molecules. 1. Molecular system identification.
Gilles Klopman
M. McGonigal
Published in:
J. Chem. Inf. Comput. Sci. (1981)
Keyphrases
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computer simulation
virtual screening
chemical reactions
drug discovery
chemical compounds
input output
molecular structure
three dimensional
molecular level
physical laws
molecular interactions
bit error rate
chemical reaction