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New insights from molecular dynamic simulation studies of the multiple binding modes of a ligand with G-quadruplex DNA.
Jin-Qiang Hou
Shuo-Bin Chen
Jia-Heng Tan
Hai-Bin Luo
Ding Li
Lian-Quan Gu
Zhi-Shu Huang
Published in:
J. Comput. Aided Mol. Des. (2012)
Keyphrases
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simulation study
dna computing
drug design
three dimensional
dynamic environments
inverted pendulum
data mining
monte carlo
sequence analysis
drug discovery
virtual screening