Combination of docking, molecular dynamics and quantum mechanical calculations for metabolism prediction of 3,4-methylenedioxybenzoyl-2-thienylhydrazone-Reference-Cited by-同舟云学术

Combination of docking, molecular dynamics and quantum mechanical calculations for metabolism prediction of 3,4-methylenedioxybenzoyl-2-thienylhydrazone

Published:2011-09-08 Issue:5 Volume:18 Page:2065-2078
ISSN:1610-2940
Container-title:Journal of Molecular Modeling
language:en
Short-container-title:J Mol Model

Author:

Braga Rodolpho C.,Alves Vinícius M.,Fraga Carlos A. M.,Barreiro Eliezer J.,de Oliveira Valéria,Andrade Carolina H.

Publisher

Springer Science and Business Media LLC

Subject

Computational Theory and Mathematics,Inorganic Chemistry,Organic Chemistry,Physical and Theoretical Chemistry,Computer Science Applications,Catalysis

Link

http://link.springer.com/content/pdf/10.1007/s00894-011-1219-9.pdf

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