@article{paperid:1075718, author = {Khoshbin, Seyyedeh Zahra and Housaindokht, Mohammad Reza and Izadyar, Mohammad and Lمحمد رضا بزرگمهر and Asma Verdian}, title = {The investigation of the G-quadruplex aptamer selectivity to Pb2+ ion: a joint molecular dynamics simulation and density functional theory study}, journal = {Journal of Biomolecular Structure and Dynamics}, year = {2019}, volume = {38}, number = {12}, month = {September}, issn = {0739-1102}, pages = {3659--3675}, numpages = {16}, keywords = {Molecular dynamics simulation; Quantum mechanics calculation; Aptamer; G-quadruplex; Aptasensor; Free energy landscape}, }