Computer simulation of the association of caffeine and actinocin derivatives in aqueous solutions

BIOPHYSICS ◽  
2006 ◽  
Vol 51 (3) ◽  
pp. 335-347 ◽  
Author(s):  
A. V. Shestopalova
Keyword(s):  
Computer Simulation ◽  
Aqueous Solutions

scholarly journals Computer Simulation of Amino Acid Oligomerization in Aqueous Solutions Induced by Condensing Agent

2015 ◽  
Vol 2015 ◽  
pp. 1-6
Author(s):  
Maxim Lubov ◽  
Yuri Trushin ◽  
Igor Eliseev ◽  
Ivan Terterov ◽  
Michael Dubina
Keyword(s):  
Experimental Data ◽  
Computer Simulation ◽  
Amino Acid ◽  
Aqueous Solutions ◽  
Metal Ions ◽  
Growth Model ◽  
Physical Features ◽  
Attachment Energy

Physical features of the amino acid oligomerization were studied. Growth model of the L-Glu monomer chain induced by the condensing agent in the aqueous solutions with and without metal ions was proposed. Computer simulation of oligomerization process was conducted and from the comparison of the calculated and experimental data attachment energy of the Leuchs anhydride of L-Glu to the oligomer was estimated.

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