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Table representation of search results timeline featuring number of search results per year.

Year Number of Results
1994 1
1995 1
2001 1
2003 3
2004 2
2005 5
2006 4
2007 6
2008 6
2009 4
2010 4
2011 4
2012 6
2013 10
2014 10
2015 5
2016 6
2017 6
2018 13
2019 5
2020 6
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Similar Articles for PMID: 30393452

107 results
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Quantifying Configuration-Sampling Error in Langevin Simulations of Complex Molecular Systems.
Fass J, Sivak DA, Crooks GE, Beauchamp KA, Leimkuhler B, Chodera JD. Fass J, et al. Entropy (Basel). 2018 May;20(5):318. doi: 10.3390/e20050318. Epub 2018 Apr 26. Entropy (Basel). 2018. PMID: 30393452 Free PMC article.
Time step rescaling recovers continuous-time dynamical properties for discrete-time Langevin integration of nonequilibrium systems.
Sivak DA, Chodera JD, Crooks GE. Sivak DA, et al. J Phys Chem B. 2014 Jun 19;118(24):6466-74. doi: 10.1021/jp411770f. Epub 2014 Mar 17. J Phys Chem B. 2014. PMID: 24555448 Free PMC article.
Dimension-free path-integral molecular dynamics without preconditioning.
Korol R, Rosa-Raíces JL, Bou-Rabee N, Miller TF 3rd. Korol R, et al. J Chem Phys. 2020 Mar 14;152(10):104102. doi: 10.1063/1.5134810. J Chem Phys. 2020. PMID: 32171215
Refinement of thermostated molecular dynamics using backward error analysis.
Silveira AJ, Abreu CRA. Silveira AJ, et al. J Chem Phys. 2019 Mar 21;150(11):114110. doi: 10.1063/1.5085441. J Chem Phys. 2019. PMID: 30901992
New Langevin and gradient thermostats for rigid body dynamics.
Davidchack RL, Ouldridge TE, Tretyakov MV. Davidchack RL, et al. J Chem Phys. 2015 Apr 14;142(14):144114. doi: 10.1063/1.4916312. J Chem Phys. 2015. PMID: 25877569 Free article.
Velocity jump processes: An alternative to multi-timestep methods for faster and accurate molecular dynamics simulations.
Monmarché P, Weisman J, Lagardère L, Piquemal JP. Monmarché P, et al. J Chem Phys. 2020 Jul 14;153(2):024101. doi: 10.1063/5.0005060. J Chem Phys. 2020. PMID: 32668932
Long timestep dynamics of peptides by the dynamics driver approach.
Derreumaux P, Schlick T. Derreumaux P, et al. Proteins. 1995 Apr;21(4):282-302. doi: 10.1002/prot.340210403. Proteins. 1995. PMID: 7567951
Unbiased reduced density matrices and electronic properties from full configuration interaction quantum Monte Carlo.
Overy C, Booth GH, Blunt NS, Shepherd JJ, Cleland D, Alavi A. Overy C, et al. J Chem Phys. 2014 Dec 28;141(24):244117. doi: 10.1063/1.4904313. J Chem Phys. 2014. PMID: 25554143
Macromolecular crowding: chemistry and physics meet biology (Ascona, Switzerland, 10-14 June 2012).
Foffi G, Pastore A, Piazza F, Temussi PA. Foffi G, et al. Phys Biol. 2013 Aug;10(4):040301. doi: 10.1088/1478-3975/10/4/040301. Epub 2013 Aug 2. Phys Biol. 2013. PMID: 23912807
Pushing the Limits of Multiple-Time-Step Strategies for Polarizable Point Dipole Molecular Dynamics.
Lagardère L, Aviat F, Piquemal JP. Lagardère L, et al. J Phys Chem Lett. 2019 May 16;10(10):2593-2599. doi: 10.1021/acs.jpclett.9b00901. Epub 2019 May 7. J Phys Chem Lett. 2019. PMID: 31050904
107 results
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