1. Particle methods in natural science and engineering

   • Christian Holm
   • Thomas Ertl
   • Joachim Gross

   Editorial 08 March 2019 Pages: 1493 - 1499

2. Fully implicit time integration in truly incompressible SPH

   • Manuel Hopp-Hirschler
   • Ulrich Nieken

   Regular Article 08 March 2019 Pages: 1501 - 1514

3. Developing coarse-grained models for agglomerate growth

   • Milena Smiljanic
   • Rudolf Weeber
   • Andreas Kronenburg

   Regular Article 08 March 2019 Pages: 1515 - 1527

4. On the use of transport properties to discriminate Mie-type molecular models for 1-propanol optimized against VLE data

   • Jörg Baz
   • Niels Hansen
   • Joachim Gross

   Regular Article 08 March 2019 Pages: 1529 - 1545

5. Studying equilibria of polymers in solution by direct molecular dynamics simulations: poly(N-isopropylacrylamide) in water as a test case

   • Edder J. García
   • Hans Hasse

   Regular Article 08 March 2019 Pages: 1547 - 1558

6. Precipitation, planar defects and dislocations in alloys: Simulations on Ni₃Si and Ni₃Al precipitates

   • Stephen Hocker
   • Hansjörg Lipp
   • Siegfried Schmauder

   Regular Article 08 March 2019 Pages: 1559 - 1574

7. A wide-range modeling approach for the thermal conductivity and dielectric function of solid and liquid aluminum

   • Eugen Eisfeld
   • Hans-Rainer Trebin
   • Johannes Roth

   Regular Article 08 March 2019 Pages: 1575 - 1590

8. Vacancy defect centers in diamond: influence of surface termination

   • Jens Hertkorn
   • Jörg Wrachtrup
   • Maria Fyta

   Regular Article 08 March 2019 Pages: 1591 - 1601

9. High-order Particle-In-Cell simulations of laser-plasma interaction

   • Stephen M. Copplestone
   • Marcel Pfeiffer
   • Claus-Dieter Munz

   Regular Article 08 March 2019 Pages: 1603 - 1614

10. Performance of state-of-the-art force fields for atomistic simulations of silicon at high electronic temperatures

    • Bernd Bauerhenne
    • Martin E. Garcia

    Regular Article 08 March 2019 Pages: 1615 - 1629

11. Molecular simulations of enzymes under non-natural conditions

    • Valerio Ferrario
    • Jürgen Pleiss

    Regular Article 08 March 2019 Pages: 1631 - 1638

12. Modeling the current modulation of dsDNA in nanopores – from mean-field to atomistic and back

    • Florian Weik
    • Kai Szuttor
    • Christian Holm

    Regular Article 08 March 2019 Pages: 1639 - 1655

13. Copper coordination in formylglycine generating enzymes

    • Sonia Álvarez-Barcia
    • Johannes Kästner

    Regular Article 08 March 2019 Pages: 1657 - 1664

14. Unfolding of DNA by co-solutes: insights from Kirkwood–Buff integrals and transfer free energies

    • Ewa Anna Oprzeska-Zingrebe
    • Miriam Kohagen
    • Jens Smiatek

    Regular Article 08 March 2019 Pages: 1665 - 1679

15. Diamondoid-functionalized nanogaps: from small molecules to electronic biosensing

    • Frank C. Maier
    • Chandra S. Sarap
    • Maria Fyta

    Regular Article 08 March 2019 Pages: 1681 - 1692

16. Dynamics of the full-length yeast Hsp90 dimer

    • Florian Kandzia
    • Martin Zacharias

    Regular Article 08 March 2019 Pages: 1693 - 1704

17. A decade of particle-based scientific visualization

    • Guido Reina
    • Patrick Gralka
    • Thomas Ertl

    Review 08 March 2019 Pages: 1705 - 1723

18. Interactive visualization of biomolecules’ dynamic and complex properties

    • Karsten Schatz
    • Michael Krone
    • Thomas Ertl

    Review 08 March 2019 Pages: 1725 - 1739

19. Multivariate visualization of particle data

    • Liang Zhou
    • Daniel Weiskopf

    Review 08 March 2019 Pages: 1741 - 1755

20. Adaptive grid implementation for parallel continuum mechanics methods in particle simulations

    • Miriam Mehl
    • Michael Lahnert

    Review 08 March 2019 Pages: 1757 - 1778

21. Enabling unstructured domain decompositions for inhomogeneous short-range molecular dynamics in ESPResSo

    • Steffen Hirschmann
    • Colin W. Glass
    • Dirk Pflüger

    Regular Article 08 March 2019 Pages: 1779 - 1788

22. ESPResSo 4.0 – an extensible software package for simulating soft matter systems

    • Florian Weik
    • Rudolf Weeber
    • Christian Holm

    Regular Article 08 March 2019 Pages: 1789 - 1816

23. MegaMol – a comprehensive prototyping framework for visualizations

    • Patrick Gralka
    • Michael Becher
    • Thomas Ertl

    Regular Article 08 March 2019 Pages: 1817 - 1829

24. IMD – the ITAP molecular dynamics simulation package

    • Johannes Roth
    • Eugen Eisfeld
    • Hans-Rainer Trebin

    Regular Article 08 March 2019 Pages: 1831 - 1836