Liu, Z., Ensing, B., & Moore, P. B. (2011). Quantitative assessment of force fields on both low-energy conformational basins and transition-state regions of the (phi-psi) space. Journal of Chemical Theory and Computation, 7(2), 402-419. https://doi.org/10.1021/ct100395n

Oxford, G. A. E., Dubbeldam, D., Broadbelt, L. J., & Snurr, R. Q. (2011). Elucidating steric effects on enantioselective epoxidation catalyzed by (salen)Mn in metal-organic frameworks. Journal of Molecular Catalysis A-Chemical, 334(1-2), 89-97. https://doi.org/10.1016/j.molcata.2010.11.001

Nielsen, S. O., Moore, P. B., & Ensing, B. (2011). Comment on "Adaptive multiscale molecular dynamics of macromolecular fluids'': reply. Physical Review Letters, 107(9). https://doi.org/10.1103/PhysRevLett.107.099802

Schalkx, H., Iedema, P., Reissland, B., & van Velzen, B. (2011). Aqueous treatment of water-sensitive paper objects: capillary unit, blotter wash or paraprint wash? Journal of Paper Conservation, 12(1), 11-20. http://www.iada-home.org/journal-of-paperconservation/archiv/pr0111-t.html

Lu, W., Yuan, D., Sculley, J., Zhao, D., Krishna, R., & Zhou, H.-C. (2011). Sulfonate-grafted porous polymer networks for preferential CO(2) adsorption at low pressure. Journal of the American Chemical Society, 133(45), 18126-18129. https://doi.org/10.1021/ja2087773

Hibbe, F., van Baten, J. M., Krishna, R., Chmelik, C., Weitkamp, J., & Kärger, J. (2011). In-depth study of mass transfer in nanoporous materials by micro-imaging. Chemie Ingenieur Technik, 83(12), 2211-2218. https://doi.org/10.1002/cite.201100167

Bolhuis, P. G., & Lechner, W. (2011). On the relation between projections of the reweighted path ensemble. Journal of Statistical Physics, 145(4), 841-859. https://doi.org/10.1007/s10955-011-0324-6

Rupenyan, A. B., Vreede, J., van Stokkum, I. H. M., Hospes, M., Kennis, J. T. M., Hellingwerf, K. J., & Groot, M. L. (2011). Proline 68 enhances photoisomerization yield in photoactive yellow protein. The journal of Physical Chemistry. B, 115(20), 6668-6677. https://doi.org/10.1021/jp112113s

Seehamart, K., Chmelik, C., Krishna, R., & Fritzsche, S. (2011). Molecular dynamics investigation of the self-diffusion of binary mixture diffusion in the metal-organic framework Zn(tbip) accounting for framework flexibility. Microporous and Mesoporous Materials, 143(1), 125-131. https://doi.org/10.1016/j.micromeso.2011.02.018

Krishna, R., & van Baten, J. M. (2011). In silico screening of metal-organic frameworks in separation applications. Physical Chemistry Chemical Physics, 13(22), 10593-10616. https://doi.org/10.1039/c1cp20282k