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Table representation of search results timeline featuring number of search results per year.
Year | Number of Results |
---|---|
2008 | 1 |
2009 | 3 |
2010 | 3 |
2024 | 0 |
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7 results
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Page 1
Molecular modeling and dynamics studies with explicit inclusion of electronic polarizability. Theory and applications.
Theor Chem Acc. 2009 Sep;124(1-2):11-28. doi: 10.1007/s00214-009-0617-x.
Theor Chem Acc. 2009.
PMID: 20577578
Free PMC article.
Update of the CHARMM all-atom additive force field for lipids: validation on six lipid types.
Klauda JB, Venable RM, Freites JA, O'Connor JW, Tobias DJ, Mondragon-Ramirez C, Vorobyov I, MacKerell AD Jr, Pastor RW.
Klauda JB, et al.
J Phys Chem B. 2010 Jun 17;114(23):7830-43. doi: 10.1021/jp101759q.
J Phys Chem B. 2010.
PMID: 20496934
Free PMC article.
Item in Clipboard
Accurate Calculation of Hydration Free Energies using Pair-Specific Lennard-Jones Parameters in the CHARMM Drude Polarizable Force Field.
Baker CM, Lopes PE, Zhu X, Roux B, Mackerell AD Jr.
Baker CM, et al.
J Chem Theory Comput. 2010 Mar 1;6(4):1181-1198. doi: 10.1021/ct9005773.
J Chem Theory Comput. 2010.
PMID: 20401166
Free PMC article.
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Simulating Monovalent and Divalent Ions in Aqueous Solution Using a Drude Polarizable Force Field.
Yu H, Whitfield TW, Harder E, Lamoureux G, Vorobyov I, Anisimov VM, Mackerell AD Jr, Roux B.
Yu H, et al.
J Chem Theory Comput. 2010;6(3):774-786. doi: 10.1021/ct900576a.
J Chem Theory Comput. 2010.
PMID: 20300554
Free PMC article.
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Force field bias in protein folding simulations.
Freddolino PL, Park S, Roux B, Schulten K.
Freddolino PL, et al.
Biophys J. 2009 May 6;96(9):3772-80. doi: 10.1016/j.bpj.2009.02.033.
Biophys J. 2009.
PMID: 19413983
Free PMC article.
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Many-body polarization effects and the membrane dipole potential.
Harder E, Mackerell AD Jr, Roux B.
Harder E, et al.
J Am Chem Soc. 2009 Mar 4;131(8):2760-1. doi: 10.1021/ja806825g.
J Am Chem Soc. 2009.
PMID: 19199514
Free PMC article.
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On the origin of the electrostatic potential difference at a liquid-vacuum interface.
Harder E, Roux B.
Harder E, et al.
J Chem Phys. 2008 Dec 21;129(23):234706. doi: 10.1063/1.3027513.
J Chem Phys. 2008.
PMID: 19102551
Free PMC article.
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