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Please cite the following when you use this software.
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[1] Crystal N. Nguyen, Michael K. Gilson, Tom Young. Structure and Thermodynamics of Molecular Hydration via Grid Inhomogeneous Solvation Theory. eprint arXiv:1108.4876, (2011).
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[1] Haider K, Cruz A, Ramsey S, Gilson M. and Kurtzman T. Solvation Structure and Thermodynamic Mapping (SSTMap): An Open-Source, Flexible Package for the Analysis of Water in Molecular Dynamics Trajectories. J. Chem. Theory Comput. (10.1021/acs.jctc.7b00592) 2017.
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[2] Crystal N. Nguyen, Michael K. Gilson, Tom Young. Structure and Thermodynamics of Molecular Hydration via Grid Inhomogeneous Solvation Theory. eprint arXiv:1108.4876, (2011).
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[2] Crystal N. Nguyen, Tom Kurtzman Young, and Michael K. Gilson. Grid inhomogeneous solvation theory: hydration structure and thermodynamics of the miniature receptor cucurbit[7]uril. J. Chem. Phys. 137, 044101 (2012)
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[3] Crystal N. Nguyen, Tom Kurtzman Young, and Michael K. Gilson. Grid inhomogeneous solvation theory: hydration structure and thermodynamics of the miniature receptor cucurbit[7]uril. J. Chem. Phys. 137, 044101 (2012)
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[3] Haider K, Wickstrom L, Ramsey S, Gilson MK and Kurtzman T. Enthalpic Breakdown of Water Structure on Protein Active Site Surfaces. J Phys Chem B. 120:8743-8756, (2016). http://dx.doi.org/10.1021/acs.jpcb.6b01094.
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[4] Haider K, Wickstrom L, Ramsey S, Gilson MK and Kurtzman T. Enthalpic Breakdown of Water Structure on Protein Active Site Surfaces. J Phys Chem B. 120:8743-8756, (2016). http://dx.doi.org/10.1021/acs.jpcb.6b01094.
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[4] Themis Lazaridis. Inhomogeneous Fluid Approach to Solvation Thermodynamics. 1. Theory. The Journal of Physical Chemistry B 102 (18), 3531-3541, (1998). DOI: 10.1021/jp9723574
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[5] Themis Lazaridis. Inhomogeneous Fluid Approach to Solvation Thermodynamics. 1. Theory. The Journal of Physical Chemistry B 102 (18), 3531-3541, (1998). DOI: 10.1021/jp9723574
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