Computation — Editors

Journal Contact

Computation Editorial Office
MDPI AG, St. Alban-Anlage 66, 4052 Basel, Switzerland
Tel. +41 61 683 77 34; Fax: +41 61 302 89 18
Ms. Lei Chen

Assistant Editor
MDPI Wuhan Office, No.6 Jingan Road, 5.5 Creative Industry Park, Floor 25th. 430064 Wuhan, Hubei Province, China

Computational Biology

Computational Chemistry

Computational Engineering


Prof. Dr. Karlheinz Schwarz

Vienna University of Technology, Institute of Materials Chemistry, A-1060 Vienna, Getreidemarkt 9/165-TC, Austria
Interests: density functional theory (DFT); electronic structure; chemical bonding; spectra; solids; surfaces; high performance computing; Wien2k
Prof. Dr. Rainer Breitling

Section Editor-in-Chief
Manchester Institute of Biotechnology, University of Manchester, 131 Princess Street, Manchester, M1 7DN, UK
Interests: computational systems biology; bioinformatics; metabolomics; dynamic modelling; synthetic biology
Prof. Dr. Demos T. Tsahalis *

Section Editor-in-Chief
Learning Foundation in Mechatronics (LFME), Irakleiou 17, GR-11141, Athens, Greece
Interests: mechatronics; unsteady boundary-layers; separation; vortex-induced vibrations; active control; noise; vibrations; health monitoring; structures; human response; modelling; artificial neural networks; multi-objective optimization; genetic algorithms; expert systems; artificial intelligence
* Computational Engineering

Editorial Board

Dr. Richard Alun Williams

Department of Management Science, Lancaster University Management School, Lancaster, LA1 4YX, UK
Interests: computational immunology; agent-based modelling; artificial life; simulation software engineering; complex systems analysis
Prof. Dr. Ravi P. Agarwal

Department of Mathematics, Texas A&M University - Kingsville, 700 University Blvd, Kingsville, TX 78363-8202, USA
Interests: nonlinear analysis; differential and difference equations; fixed point theory; general inequalities
Prof. Dr. Giorgio Ascoli

Center for Neural Informatics, Structure, and Plasticity Molecular Neuroscience Dept., Krasnow Institute for Advanced Study, MS2A1 - George Mason University, Fairfax, VA 22030-4444, USA
Interests: neuroinformatics; computational neuroanatomy; hippocampus; neuron types; axons; dendrites; neuronal morphology
Dr. Pietro Asinari

Multi-Scale Modeling Laboratory, Department of Energy, Politecnico di Torino, Corso Duca degli Abruzzi 24, 10129 Turin, Italy
Interests: computational and statistical physics; transport phenomena in soft matter; molecular dynamics; mesoscopic numerical methods; lattice Boltzmann method; computational fluid dynamics; high performance computing
Prof. Dr. Ali Cemal Benim

Department of Mechanical and Process Engineering, Dusseldorf, University of Applied Sciences, Josef-Gockeln-Str. 9, D-40474 Dusseldorf, Germany
Interests: numerical modelling; mathematical modelling; technical application
Prof. Dr. Vince D. Calhoun

The Mind Research Network and Departments of Electrical and Computer Engineering (primary), Neurosciences, Psychiatry and Computer Science, University of New Mexico , 1101 Yale Boulevard, NE, Albuquerque, NM 87106, USA
Interests: brain imaging; independent component analysis; functional MRI; genetics; machine learning; classification
Prof. Dr. Rita Casadio

School of Science, Biocomputing Group, University of Bologna, via Irnerio 42, 40126, Bologna, Italy
Interests: computational biology; bioinformatics; machine learning
Dr. Matt Challacombe

Theoretical Division, Los Alamos National Laboratory, Los Alamos, NM 87545, USA
Interests: fast algorithms in electronic structure, applied mathematics, linear algebra and the information sciences; the generalized n-body problem; bio-molecular simmulation; high performance computing; theoretical and computational chemistry
Prof. Dr. Dick de Ridder

Bioinformatics Group, Wageningen University, Droevendaalsesteeg 1, 6708 PB Wageningen, The Netherlands
Interests: machine learning; data integration; bioinformatics; molecular diagnostics; microbial systems biology
Prof. Dr. Dimitris Drikakis

Cranfield University, Cranfield, MK43 0AL, UK
Interests: scientific computing for fluid flow and heat transfer (CFD); materials modelling and simulation; computational nanotechnology; uncertainty modelling
Dr. Bruce Gardiner

Engineering Computational Biology, The University of Western Australia, 35 Stirling Hwy, Crawley WA 6009, Australia
Interests: computational modelling of biological systems; including intra and intercellular signalling pathways; cell-tissue interactions; poro-elasticity and transport processes in tissues
Dr. Sergey A. Karabasov

Queen Mary, University of London, School of Engineering & Materials Science,Mile End Road, London E1 4NS, UK
Interests: fluid dynamics; computational aeroacoustics and aerodynamics; large-eddy simulations; meso-scale ocean modelling; fluctuating hydrodynamics for nano-scale flows; numerical methods for hyperbolic conservation laws
Prof. Dr. Christian Klingenberg

Department of Mathematics, Würzburg University, Emil Fischer Str. 30, Würzburg, 97074, Germany
Interests: mathematical fluid mechanics; compressible gas dynamics; ideal MHD; modeling fluid flow via microscopic interacting particle systems; theory of hyperbolic conservation laws: well-posedness, relaxation limit; numerics for hyperbolic conservation laws: finite volume schemes, approximate Riemann solvers; astrophysical applications
Prof. Dr. Petros Koumoutsakos

Computational Science, ETH Zurich, Clausiusstrasse 33, CLT, F12, CH-8092, Zurich, Switzerland
Interests: computational Science; high performance computing; fluid dynamics; biology; nanotechnology
Prof. Dr. Markus Kraft

Department of Chemical Engineering and Biotechnology, University of Cambridge, Cambridge, CB2 3RA, UK
Interests: numerical methods; CFD; stochastic particle methods; population balances; combustion; nanoparticles; statistics; global optimization
Prof. Dr. Athanasios Mantalaris

Imperial College London, South Kensington Campus, London, SW7 2AZ, UK
Interests: stem cell bioprocessing; tissue engineering; mammalian cell bioprocessing
Prof. Dr. Jeffrey S. Marshall

School of Engineering, University of Vermont, 33 Colchester Blvd., 301 Votey Hall, Burlington, VT 05405, USA
Interests: computational fluid dynamics; adhesive particle flows; discrete-element modeling; vortex methods; blood flow modeling; algae biofuel; complex systems
Dr. Wolfgang Mueller-Wittig

School of Computer Engineering (SCE), Nanyang Technological University (NTU), Nanyang Avenue, Singapore 639798, Singapore
Interests: real-time rendering; virtual reality (VR); augmented reality (AR); visual analytics; visual haptics; shape modeling
Prof. Dr. Graeme Murch

Center for Mass and Thermal Transport in Engineering Materials, School of Engineering, The University of Newcastle, NSW 2308, Australia
Interests: All aspects of computational modelling of mass and thermal transport (diffusion) in materials, Monte Carlo methods, molecular dynamics, ab initio
Prof. Dr. Dominik Obrist

ARTORG Center for Biomedical Engineering Research, University of Bern, Murtenstrasse 30, 3010 Bern, Switzerland
Interests: biomedical fluid dynamics; hydrodynamic stability; transition to turbulence; aeroacoustics; numerical methods; high performance computing
Prof. Dr. Paul Popelier

1. Manchester Institute of Biotechnology (MIB), 131 Princess Street, Manchester M1 7DN, UK
2. School of Chemistry, The University of Manchester, Manchester, M13 9PL
Interests: quantum chemical topology; force field design; peptides; liquid water; bio-isosterism; quantitative structure-activity relationships; allostery; electrostatics; polarisation
Prof. Dr. Sauro Succi

1. Instituto Applicazioni Calcolo "Mauro Picone", C.N.R., Via dei Taurini, 19 00185, Rome, Italy
2. Institute for Applied Computational Science and Physics, Harvard University Oxford Street 60, Cambridge, MA 02138, USA
Interests: statistical physics; computational physics and biology; applied mathematics; classical and quantum fluid dynamics
Contribution: In other journals:
Special Issue: Non-Linear Lattice
Dr. Constantinos Theodoropoulos

School of Chemical Engineering and Analytical Science, University of Manchester, Manchester, M13 9PL, UK
Interests: multi-scale modelling and design of complex chemical and biochemical systems and processes, such as microreactor and fuel cell systems; model-reduction based computational methods for the optimisation and control of large- and multi-scale systems; experimental and computational studies for the construction of sustainable biorefineries co-producing fuels and chemicals
Prof. Dr. Jesus M. Ugalde

Kimika Fakultatea, Euskal Herriko Unibertsitatea, PK 1072, 20080, Donostia, Euskadi, Spain
Interests: quantum molecular electronic structure methods; elementary gas-phase reactivity of transition metal elements; (auto)assembling of nanoclusters; computational modeling of biochemical processes
Prof. Dr. António J. C. Varandas

Departamento de Quimica, Universidade de Coimbra, 3004-535 Coimbra, Portugal
Interests: potential energy surfaces; electronic structure calculations; intermolecular forces; chemical dynamics; non-adiabatic effects; chemistry of atmospheric ozone
Prof. Dr. Röbbe Wünschiers

University of Applied Sciences Mittweida, Biotechnology, Computational Biology, Technikumplatz 17, 09648 Mittweida, Germany
Interests: experimental and computational biology; synthetic biology; biogas production; genomics; transcriptomics; data integration; data visualization
Prof. Dr. Dennis Salahub

Department of Chemistry, CMS - Centre for Molecular Simulation, and IQST - Institute for Quantum Science and Technology, University of Calgary, Calgary, Alberta T2N 1N4, Canada
Interests: multiscale modeling; chemical reactions in complex environments; quantum chemistry; density functional theory; QM/MM; molecular dynamics; enzymatic catalysis; electron transfer; nano catalysis
Dr. Qinjun Kang

Computational Earth Science Group (EES-16), Earth and Environmental Sciences Division, Los Alamos National Laboratory, Los Alamos, NM 87545, USA
Interests: flow and transport in porous media; lattice boltzmann method; multiscale modeling; CO2 sequestration; shale gas; energy storage and conversion devices
Contribution: Special Issue: Advances in Modeling Flow and Transport in Porous Media
Prof. Dr. Yalchin Efendiev

Mobil Chair in Computational Sciences, Director of Institute for Scientific Computation (ISC), Department of Mathematics & ISC, Texas A&M University, College Station, TX 77843, USA
Interests: multiscale, porous media, upscaling, flow, transport, multiscale finite element
Prof. Dr. Malgorzata Peszynska

Department of Mathematics, Oregon State University, Corvallis, OR 97331, USA
Interests: numerical analysis for PDEs and integro-differential equations; applications to flow and transport; problems with multiscale and stochastic data
Dr. Fabio Della Sala

Consiglio Nazionale delle Ricerche (CNR) & Italian Institute of Technology (IIT), Via Barsanti, Arnesano 73010, Italy
Interests: density functional theory; quantum chemistry; nanoscience; plasmonics; condensed-matter theory
Dr. Colin W. Glass

High Performance Computing Center, University of Stuttgart, Nobelstrasse 19, 70569, Stuttgart, Germany
Interests: high performance computing; molecular simulation; parallel programming models; efficient optimization strategies; optimization in materials science
Prof. Dr. Martin Korth

Institute for Theoretical Chemistry, Ulm University, Ulm, Germany
Interests: quantum chemistry; computational chemistry; computational biochemistry; computational electrochemistry; biomolecular interactions; electrochemical energy storage; molecular materials; virtual screening; multi-scale modelling
Computation EISSN 2079-3197 Published by MDPI AG, Basel, Switzerland RSS E-Mail Table of Contents Alert