受强制性开放获取政策约束的文章 - Ahmed E. Ismail了解详情
无法在其他位置公开访问的文章：11 篇
On the Applicability of Force Fields to Study the Aggregation of Amyloidogenic Peptides Using Molecular Dynamics Simulations
M Carballo-Pacheco, AE Ismail, B Strodel
Journal of chemical theory and computation, 2018
强制性开放获取政策： German Research Foundation
Reconsidering Dispersion Potentials: Reduced Cutoffs in Mesh-Based Ewald Solvers Can Be Faster Than Truncation
RE Isele-Holder, W Mitchell, JR Hammond, A Kohlmeyer, AE Ismail
Journal of Chemical Theory and Computation 9 (12), 5412-5420, 2013
强制性开放获取政策： German Research Foundation
Effect of Water Content in N-Methylmorpholine N-Oxide/Cellulose Solutions on Thermodynamics, Structure, and Hydrogen Bonding
BD Rabideau, AE Ismail
The Journal of Physical Chemistry B 119 (48), 15014-15022, 2015
强制性开放获取政策： German Research Foundation
Oligomer formation of toxic and functional amyloid peptides studied with atomistic simulations
M Carballo-Pacheco, AE Ismail, B Strodel
The Journal of Physical Chemistry B 119 (30), 9696-9705, 2015
强制性开放获取政策： German Research Foundation
Translational Entropy and Dispersion Energy Jointly Drive the Adsorption of Urea to Cellulose
P Chen, Y Nishiyama, J Wohlert, A Lu, K Mazeau, AE Ismail
The Journal of Physical Chemistry B 121 (10), 2244-2251, 2017
强制性开放获取政策： 国家自然科学基金委员会, German Research Foundation
A continuum mechanical surrogate model for atomic beam structures
MG Schmidt, AE Ismail, RA Sauer
International Journal for Multiscale Computational Engineering 13 (5), 2015
强制性开放获取政策： German Research Foundation
Requirements for the Formation and Shape of Microscopic Precursors in Droplet Spreading
RE Isele-Holder, AE Ismail
Langmuir 32 (18), 4472-4478, 2016
强制性开放获取政策： German Research Foundation
Definition and computation of intermolecular contact in liquids using additively weighted voronoi tessellation
RE Isele-Holder, BD Rabideau, AE Ismail
The Journal of Physical Chemistry A 116 (18), 4657-4666, 2012
强制性开放获取政策： German Research Foundation
Atomistic Potentials for Trisiloxane, Alkyl Ethoxylate, and Perfluoroalkane-Based Surfactants with TIP4P/2005 and Application to Simulations at the Air–Water Interface
RE Isele-Holder, AE Ismail
The Journal of Physical Chemistry B 118 (31), 9284-9297, 2014
强制性开放获取政策： German Research Foundation
Classification of precursors in nanoscale droplets
RE Isele-Holder, AE Ismail
Physical Review E 93 (4), 043319, 2016
强制性开放获取政策： German Research Foundation
Accelerating molecular dynamics codes by performance and accuracy modeling
D Fabregat-Traver, AE Ismail, P Bientinesi
Journal of Computational Science 27, 77-90, 2018
强制性开放获取政策： German Research Foundation, Federal Ministry of Education and Research, Germany
可在其他位置公开访问的文章：10 篇
Industrial applications of enzymes: Recent advances, techniques, and outlooks
J Chapman, A Ismail, C Dinu
Catalysts 8 (6), 238, 2018
强制性开放获取政策： US National Science Foundation, US National Institutes of Health
Automated Discovery of Reaction Pathways, Rate Constants, and Transition States Using Reactive Molecular Dynamics Simulations
M Döntgen, MD Przybylski-Freund, LC Kröger, WA Kopp, AE Ismail, ...
Journal of chemical theory and computation 11 (6), 2517-2524, 2015
强制性开放获取政策： German Research Foundation
Development and application of a particle-particle particle-mesh Ewald method for dispersion interactions
RE Isele-Holder, W Mitchell, AE Ismail
The Journal of chemical physics 137 (17), 174107, 2012
强制性开放获取政策： German Research Foundation
The vectorization of the tersoff multi-body potential: an exercise in performance portability
M Höhnerbach, AE Ismail, P Bientinesi
Proceedings of the International Conference for High Performance Computing …, 2016
强制性开放获取政策： German Research Foundation, Leibniz Association
Multilevel summation for dispersion: A linear-time algorithm for r− 6 potentials
D Tameling, P Springer, P Bientinesi, AE Ismail
The Journal of chemical physics 140 (2), 024105, 2014
强制性开放获取政策： German Research Foundation
Iα to Iβ mechano-conversion and amorphization in native cellulose simulated by crystal bending
P Chen, Y Ogawa, Y Nishiyama, AE Ismail, K Mazeau
Cellulose 25 (8), 4345-4355, 2018
强制性开放获取政策： Knut and Alice Wallenberg Foundation
Smoothing of contact lines in spreading droplets by trisiloxane surfactants and its relevance for superspreading
RE Isele-Holder, B Berkels, AE Ismail
Soft matter 11 (22), 4527-4539, 2015
强制性开放获取政策： German Research Foundation
Multiscale treatment of mechanical contact problems involving thin polymeric layers
MG Schmidt, RA Sauer, AE Ismail
Modelling and Simulation in Materials Science and Engineering 22 (4), 045012, 2014
强制性开放获取政策： German Research Foundation
A Scalable, Linear-Time Dynamic Cutoff Algorithm for Molecular Dynamics
P Springer, AE Ismail, P Bientinesi
International Conference on High Performance Computing, 155-170, 2015
强制性开放获取政策： German Research Foundation
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