@article{rogalewicz:hal-00904630, TITLE = {{Interaction of neutral and zwitterionic glycine with Zn2+ in gas phase: ab initio and SIBFA molecular mechanics calculations}}, AUTHOR = {Rogalewicz, Fran{\c c}oise and Ohanessian, Gilles and Gresh, Nohad}, URL = {https://polytechnique.hal.science/hal-00904630}, JOURNAL = {{Journal of Computational Chemistry}}, PUBLISHER = {{Wiley}}, VOLUME = {21}, NUMBER = {11}, PAGES = {963-976}, YEAR = {2000}, DOI = {10.1002/1096-987X(200008)21:11<963::AID-JCC6>3.0.CO;2-3}, HAL_ID = {hal-00904630}, HAL_VERSION = {v1}, }