Year |
Citation |
Score |
2020 |
Houshmand F, Friedman R, Jalili S, Schofield J. Exciton effect in new generation of carbon nanotubes: graphdiyne nanotubes. Journal of Molecular Modeling. 26: 171. PMID 32524265 DOI: 10.1007/S00894-020-04401-9 |
0.326 |
|
2019 |
Huang MJ, Schofield J, Gaspard P, Kapral R. From single particle motion to collective dynamics in Janus motor systems. The Journal of Chemical Physics. 150: 124110. PMID 30927899 DOI: 10.1063/1.5081820 |
0.323 |
|
2018 |
Huang MJ, Schofield J, Gaspard P, Kapral R. Dynamics of Janus motors with microscopically reversible kinetics. The Journal of Chemical Physics. 149: 024904. PMID 30007391 DOI: 10.1063/1.5029344 |
0.33 |
|
2017 |
Schofield J. Optimization and Automation of the Construction of Smooth Free Energy Profiles. The Journal of Physical Chemistry. B. PMID 28640619 DOI: 10.1021/Acs.Jpcb.7B04871 |
0.315 |
|
2017 |
Huang M, Schofield J, Kapral R. Transport in active systems crowded by obstacles Journal of Physics a: Mathematical and Theoretical. 50: 074001. DOI: 10.1088/1751-8121/50/7/074001 |
0.317 |
|
2017 |
Huang M, Schofield J, Kapral R. Chemotactic and hydrodynamic effects on collective dynamics of self-diffusiophoretic Janus motors New Journal of Physics. 19: 125003. DOI: 10.1088/1367-2630/Aa958C |
0.347 |
|
2016 |
Jalili S, Akhavan M, Schofield J. Effect of point defects on the properties of silicene-like BSi3 sheets from first-principles Journal of Physics and Chemistry of Solids. 95: 106-113. DOI: 10.1016/J.Jpcs.2016.04.004 |
0.301 |
|
2015 |
Jalili S, Maleki A, Akhavan M, Najafi B, Schofield J. Free energy simulations of amylin I26P mutation in a lipid bilayer. European Biophysics Journal : Ebj. 44: 37-47. PMID 25427619 DOI: 10.1007/S00249-014-0999-0 |
0.309 |
|
2015 |
Jalili S, Houshmand F, Schofield J. Study of carrier mobility of tubular and planar graphdiyne Applied Physics a: Materials Science and Processing. 119: 571-579. DOI: 10.1007/S00339-015-8992-8 |
0.346 |
|
2014 |
Schofield J, Bayat H. Derivation of a Markov state model of the dynamics of a protein-like chain immersed in an implicit solvent. The Journal of Chemical Physics. 141: 095101. PMID 25194395 DOI: 10.1063/1.4894436 |
0.358 |
|
2014 |
Burger SK, Ayers PW, Schofield J. Efficient parameterization of torsional terms for force fields. Journal of Computational Chemistry. 35: 1438-45. PMID 24831846 DOI: 10.1002/Jcc.23636 |
0.359 |
|
2013 |
Burger SK, Schofield J, Ayers PW. Quantum mechanics/molecular mechanics restrained electrostatic potential fitting. The Journal of Physical Chemistry. B. 117: 14960-6. PMID 24176005 DOI: 10.1021/Jp409568H |
0.308 |
|
2013 |
Hsieh C, Schofield J, Kapral R. Forward–backward solution of quantum-classical Liouville equation in the adiabatic mapping basis Molecular Physics. 111: 3546-3554. DOI: 10.1080/00268976.2013.837207 |
0.325 |
|
2012 |
Raghu RC, Schofield J. Simulation of tethered oligomers in nanochannels using multi-particle collision dynamics. The Journal of Chemical Physics. 137: 014901. PMID 22779677 DOI: 10.1063/1.4731662 |
0.326 |
|
2012 |
Movahed HB, van Zon R, Schofield J. Free energy landscape of protein-like chains with discontinuous potentials. The Journal of Chemical Physics. 136: 245103. PMID 22755604 DOI: 10.1063/1.4729850 |
0.332 |
|
2012 |
Schofield J, Inder P, Kapral R. Modeling of solvent flow effects in enzyme catalysis under physiological conditions. The Journal of Chemical Physics. 136: 205101. PMID 22667589 DOI: 10.1063/1.4719539 |
0.336 |
|
2012 |
Kelly A, van Zon R, Schofield J, Kapral R. Mapping quantum-classical Liouville equation: projectors and trajectories. The Journal of Chemical Physics. 136: 084101. PMID 22380026 DOI: 10.1063/1.3685420 |
0.327 |
|
2010 |
van Zon R, Schofield J. Constructing smooth potentials of mean force, radial distribution functions, and probability densities from sampled data. The Journal of Chemical Physics. 132: 154110. PMID 20423171 DOI: 10.1063/1.3366523 |
0.34 |
|
2008 |
van Zon R, Hernández de la Peña L, Peslherbe GH, Schofield J. Quantum free-energy differences from nonequilibrium path integrals. II. Convergence properties for the harmonic oscillator. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 78: 041104. PMID 18999376 DOI: 10.1103/Physreve.78.041104 |
0.332 |
|
2008 |
van Zon R, Hernández de la Peña L, Peslherbe GH, Schofield J. Quantum free-energy differences from nonequilibrium path integrals. I. Methods and numerical application. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 78: 041103. PMID 18999375 DOI: 10.1103/Physreve.78.041103 |
0.378 |
|
2008 |
van Zon R, Schofield J. Event-driven dynamics of rigid bodies interacting via discretized potentials. The Journal of Chemical Physics. 128: 154119. PMID 18433202 DOI: 10.1063/1.2901173 |
0.33 |
|
2008 |
van Zon R, Omelyan IP, Schofield J. Efficient algorithms for rigid body integration using optimized splitting methods and exact free rotational motion. The Journal of Chemical Physics. 128: 136102. PMID 18397113 DOI: 10.1063/1.2889937 |
0.306 |
|
2007 |
Hernández de la Peña L, van Zon R, Schofield J, Opps SB. Discontinuous molecular dynamics for rigid bodies: applications. The Journal of Chemical Physics. 126: 074106. PMID 17328592 DOI: 10.1063/1.2434959 |
0.366 |
|
2007 |
Hernández de la Peña L, van Zon R, Schofield J, Opps SB. Discontinuous molecular dynamics for semiflexible and rigid bodies. The Journal of Chemical Physics. 126: 074105. PMID 17328591 DOI: 10.1063/1.2434957 |
0.313 |
|
2007 |
van Zon R, Schofield J. Numerical implementation of the exact dynamics of free rigid bodies Journal of Computational Physics. 225: 145-164. DOI: 10.1016/J.Jcp.2006.11.019 |
0.308 |
|
2005 |
van Zon R, Schofield J. Mode-coupling theory for multiple-time correlation functions of tagged particle densities and dynamical filters designed for glassy systems. The Journal of Physical Chemistry. B. 109: 21425-36. PMID 16853780 DOI: 10.1021/Jp052234G |
0.379 |
|
2005 |
van Zon R, Schofield J. Glassy dynamics and domains: explicit results for the East model. The Journal of Chemical Physics. 122: 194502. PMID 16161592 DOI: 10.1063/1.1897372 |
0.308 |
|
2005 |
Schofield J. Quantum effects in ab-initio calculations of rate constants for chemical reactions occuring in the condensed phase Theoretical Chemistry Accounts. 116: 18-30. DOI: 10.1007/S00214-005-0017-9 |
0.399 |
|
2004 |
Plyukhin AV, Schofield J. Langevin equation for the extended Rayleigh model with an asymmetric bath. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 69: 021112. PMID 14995432 DOI: 10.1103/Physreve.69.021112 |
0.323 |
|
2003 |
Plyukhin AV, Schofield J. Langevin equation for the Rayleigh model with finite-range interactions. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 68: 041107. PMID 14682923 DOI: 10.1103/Physreve.68.041107 |
0.325 |
|
2003 |
Iftimie R, Salahub D, Schofield J. An efficient Monte Carlo method for calculating ab initio transition state theory reaction rates in solution Journal of Chemical Physics. 119: 11285-11297. DOI: 10.1063/1.1622653 |
0.699 |
|
2002 |
Marcus AH, Schofield J, Rice SA. Experimental observations of non-Gaussian behavior and stringlike cooperative dynamics in concentrated quasi-two-dimensional colloidal liquids. Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 60: 5725-36. PMID 11970468 DOI: 10.1103/Physreve.60.5725 |
0.641 |
|
2002 |
Plyukhin AV, Schofield J. Trapping, reflection, and fragmentation in a classical model of atom-lattice collisions. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 65: 026603. PMID 11863674 DOI: 10.1103/Physreve.65.026603 |
0.316 |
|
2002 |
van Zon R, Schofield J. Multiple-point and multiple-time correlation functions in a hard-sphere fluid. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 65: 011107. PMID 11800677 DOI: 10.1103/Physreve.65.011107 |
0.372 |
|
2002 |
van Zon R, Schofield J. Mode-coupling theory for multiple-point and multiple-time correlation functions. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 65: 011106. PMID 11800676 DOI: 10.1103/Physreve.65.011106 |
0.372 |
|
2002 |
Wan C, Schofield J. Solutions of mixed quantum-classical dynamics in multiple dimensions using classical trajectories The Journal of Chemical Physics. 116: 494-506. DOI: 10.1063/1.1425835 |
0.376 |
|
2002 |
Iftimie R, Schofield J. Separation of quantum and classical behavior in proton transfer reactions: Implications from studies of secondary kinetic isotope effects International Journal of Quantum Chemistry. 91: 404-413. DOI: 10.1002/Qua.10392 |
0.707 |
|
2001 |
Plyukhin AV, Schofield J. Stochastic dynamics with a mesoscopic bath. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 64: 041103. PMID 11690006 DOI: 10.1103/Physreve.64.041103 |
0.333 |
|
2001 |
Plyukhin AV, Schofield J. Stochastic model related to the Klein-Gordon equation. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 64: 037101. PMID 11580480 DOI: 10.1103/Physreve.64.037101 |
0.34 |
|
2001 |
Opps SB, Schofield J. Extended state-space Monte Carlo methods. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 63: 056701. PMID 11415039 DOI: 10.1103/Physreve.63.056701 |
0.342 |
|
2001 |
Iftimie R, Schofield J. Reaction mechanism and isotope effects derived from centroid transition state theory in intramolecular proton transfer reactions The Journal of Chemical Physics. 115: 5891-5902. DOI: 10.1063/1.1399060 |
0.709 |
|
2001 |
Iftimie R, Schofield J. Efficient ab initio sampling methods in rate constant calculations for proton-transfer reactions The Journal of Chemical Physics. 114: 6763-6773. DOI: 10.1063/1.1357793 |
0.713 |
|
2000 |
Marcus AH, Schofield J, Rice S. Erratum: Experimental observations of non-Gaussian behavior and stringlike cooperative dynamics in concentrated quasi-two-dimensional colloidal liquids [Phys. Rev. E60, 5725 (1999)] Physical Review E. 61: 7260-7260. DOI: 10.1103/Physreve.61.7260 |
0.61 |
|
2000 |
Wan C, Schofield J. Exact and asymptotic solutions of the mixed quantum-classical Liouville equation The Journal of Chemical Physics. 112: 4447-4459. DOI: 10.1063/1.481007 |
0.381 |
|
2000 |
Wan C, Schofield J. Mixed quantum-classical molecular dynamics: Aspects of the multithreads algorithm The Journal of Chemical Physics. 113: 7047-7054. DOI: 10.1063/1.1313525 |
0.362 |
|
2000 |
Iftimie R, Salahub D, Wei D, Schofield J. Using a classical potential as an efficient importance function for sampling from an ab initio potential Journal of Chemical Physics. 113: 4852-4862. DOI: 10.1063/1.1289534 |
0.705 |
|
1998 |
Schofield J, Ratner MA. Monte Carlo methods for short polypeptides The Journal of Chemical Physics. 109: 9177-9191. DOI: 10.1063/1.477471 |
0.468 |
|
1996 |
Schofield J, Marcus AH, Rice SA. Dynamics of Quasi Two-Dimensional Colloidal Systems The Journal of Physical Chemistry. 100: 18950-18961. DOI: 10.1021/Jp961171M |
0.645 |
|
1995 |
Schofield J, Rice SA. Backbone ordering in amphiphile monolayers The Journal of Chemical Physics. 103: 5792-5801. DOI: 10.1063/1.470460 |
0.442 |
|
1994 |
Schofield J, Oppenheim I. Mode coupling in nonequilibrium granular flow systems Physica a: Statistical Mechanics and Its Applications. 204: 555-605. DOI: 10.1016/0378-4371(94)90448-0 |
0.521 |
|
1993 |
Schofield J, Oppenheim I. The hydrodynamics of inelastic granular systems Physica a: Statistical Mechanics and Its Applications. 196: 209-240. DOI: 10.1016/0378-4371(93)90601-Y |
0.517 |
|
1992 |
Schofield J, Oppenheim I. Mode coupling and tagged particle correlation functions: the Stokes-Einstein law Physica a: Statistical Mechanics and Its Applications. 187: 210-242. DOI: 10.1016/0378-4371(92)90419-Q |
0.526 |
|
1992 |
Schofield J, Lim R, Oppenheim I. Mode coupling and generalized hydrodynamics Physica a: Statistical Mechanics and Its Applications. 181: 89-135. DOI: 10.1016/0378-4371(92)90198-Y |
0.505 |
|
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