@article{paperid:1048856, author = {Khavani, Mohammad and Izadyar, Mohammad and Housaindokht, Mohammad Reza}, title = {DFT investigation and molecular dynamic simulation on the selectivecomplexation of cis-cyclic nanopeptides with alkaline earth metalions}, journal = {Sensors and Actuators B: Chemical}, year = {2015}, volume = {221}, number = {16}, month = {August}, issn = {0925-4005}, pages = {1120--1129}, numpages = {9}, keywords = {Ion-selective complex; Cyclic peptide; Electron density; Electrostatic interaction; Molecular dynamics}, }