- David van der Spoel Tuesday, 23 April 2019
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JPCB Letter
Sunday, 04 November 2007
Alexandra's new paper "A Direct Comparison of Protein Structure in the Gas and Solution Phase: the Trp-cage" has appeared as a letter in J. Phys. Chem. B. It features the structural comparison of a small protein in gas and solution phase, after we determined that the charge states are identical. The paper also features semi-empirical energy calculations of these 300 atom proteins in the gas-phase. 
(c) 2006 David van der Spoel