• Applied computational science can be divided into a number of different components: mathematics, modeling, statistics, and programming. (lu.se)
  • The Master Programme in Applied Computational Science will give you detailed knowledge about the underlying methods with respect to Natural Science. (lu.se)
  • You will learn how to study complex processes in natural sciences, and how Applied Computational Science can contribute to knowledge evolution in society. (lu.se)
  • It uses methods of theoretical chemistry, incorporated into computer programs, to calculate the structures and properties of molecules, groups of molecules, and solids. (wikipedia.org)
  • I argued the use of computational concepts, methods, and tools would transform the very conduct of every discipline, profession, and sector. (acm.org)
  • Today, with the advent of massive amounts of data, researchers in all disciplines-including the arts, humanities and social sciences-are discovering new knowledge using computational methods and tools. (acm.org)
  • He is the author or editor of several textbooks on sociological methods of research and statistics and was the founding editor of the Journal of Artificial Societies and Social Simulation as well as helping to establish the innovative online journal, Sociological Research Online . (surrey.ac.uk)
  • Important methods and research approaches using simulation technology for the study of human speech can also be found in natural language processing and speech signal processing as well as in areas of computer science such as artificial intelligence and machine learning. (uni-stuttgart.de)
  • Computational methods used on different length and time scales for the simulation of materials structures and behavior are described along with process features involved in the implementation, verification, and validation of computer simulations. (springer.com)
  • Benson DJ (1992) Computational methods in Lagrangian and Eulerial hydrocodes. (springer.com)
  • Four of the undergraduates, who have experience in computational methods, worked on independent research projects. (broadinstitute.org)
  • You will also get hands-on experience through solving an optimal scheduling problem, noting the differences between different numerical simulation methods and applying machine learning to predict system overloads. (edx.org)
  • Since answers to this question often relate computer simulation to other methods, e.g., experimentation, they also tell us what kind of method computer simulation is. (oxfordbibliographies.com)
  • These progress would have been unreachable without innovative analytic and computational methods for developing reduced descriptions of physics phenomena. (inria.fr)
  • With computational modeling, researchers can use several data streams and apply mathematical methods to figure out what might happen in a chemical incident or outbreak. (cdc.gov)
  • Absorbed dose is assessed using measurements and computational methods and using different risk assessments methods. (lu.se)
  • The department is also currently involved in an EU funded radiation protection project "Personal Online DosImetry Using computational Methods" (PODIUM). (lu.se)
  • Computational chemistry is a branch of chemistry that uses computer simulation to assist in solving chemical problems. (wikipedia.org)
  • The goal of computational chemistry is to minimize this residual error while keeping the calculations tractable. (wikipedia.org)
  • The books that were influential in the early development of computational quantum chemistry include Linus Pauling and E. Bright Wilson's 1935 Introduction to Quantum Mechanics - with Applications to Chemistry, Eyring, Walter and Kimball's 1944 Quantum Chemistry, Heitler's 1945 Elementary Wave Mechanics - with Applications to Quantum Chemistry, and later Coulson's 1952 textbook Valence, each of which served as primary references for chemists in the decades to follow. (wikipedia.org)
  • While the focus of that learning has broadened within the field of chemistry - including environmental, analytical, computational and materials chemistry - the desire to create something to help his country and the world has remained constant. (msvu.ca)
  • That work focused on computational chemistry, which uses computer simulation to assist in solving chemical problems. (msvu.ca)
  • Today, says Sichinga, he is one of a handful of chemistry researchers with expertise in both computational and materials chemistry. (msvu.ca)
  • Computational modelling is used as a predictive tool and ensures the chemistry is 'green' before the materials are synthesized in the laboratory," notes Sichinga. (msvu.ca)
  • The successful candidate will have strong experience in molecular modelling and simulations and statistical mechanics and will hold a PhD/DPhil in physics, chemistry, quantitative biology, applied mathematics, or a closely related field, with a strong interest in biological systems. (lu.se)
  • Assessment of a non-traditional operator split algorithm for simulation of reactive transport. (uni-trier.de)
  • Should the computational plumber use the same tools as the algorithm designer? (oreilly.com)
  • Our simulation study showed our algorithm reached comparative accuracy comparing to the oracle estimator where data are pooled together. (nih.gov)
  • 60, pp. 187-207, and generalized in a series of subsequent papers L. Greengard and V. Rokhlin (1987), A fast algorithm for particle simulations, J. Comput. (netlib.org)
  • J. Carrier, L. Greengard, and V. Rokhlin (1988), A fast adaptive multipole algorithm for particle simulations, SIAM J. Sci. (netlib.org)
  • While computational results normally complement the information obtained by chemical experiments, it can in some cases predict hitherto unobserved chemical phenomena. (wikipedia.org)
  • In this thesis I will discuss my work to fill this gap in understanding by studying the unfolding and refolding of large, multidomain proteins using the powerful combination of single-molecule force-spectroscopy experiments and molecular dynamic simulations. (duke.edu)
  • One goal of this thesis is to give a representative overview of computer simulation experiments in phonetics and phonology. (uni-stuttgart.de)
  • Chapter 2 provides a short historical and a detailed thematic overview of the literature and presents the various research questions which have been studied with computer simulation experiments. (uni-stuttgart.de)
  • Computer simulation experiments allow the investigation of phenomena which are empirically hard to capture or even totally inaccessible. (uni-stuttgart.de)
  • The second part of this thesis presents a series of my own computer simulation experiments and discusses relevant work. (uni-stuttgart.de)
  • Computer simulation experiments can not only complement laborious empirical studies and replace them to some extent. (uni-stuttgart.de)
  • Computer simulation has revolutionized the research tools of engineers and is nowadays, besides theory and experiments, essential to many scientists. (epfl.ch)
  • To make predictions, analyzes or to replace experiments, we use numerical simulations and machine learning on large computers. (lu.se)
  • Computational modeling also allows researchers to g enerate reliable data without using human subjects or lab animals in experiments . (cdc.gov)
  • Gives you knowledge in how to use numerical simulations and machine learning to make forecasts and analyses, or to replace experiments. (lu.se)
  • To obtain a molecular understanding of IDPs, a combined approach of experiments and simulations is useful. (lu.se)
  • Several steps were completed from the modeling of the carbon structures and pollutants to simulations of molecular dynamics. (academicjournals.org)
  • The TRR-SFB is closely integrated into the structures at both universities, such as the Centre for Computational Engineering (CCE) at TU Darmstadt and the Graz Center of Computational Engineering (GCCE). (tugraz.at)
  • First, based on the imaging data of a specific patient, anatomical structures need to be identified (termed "image segmentation") to create a computer model geometry for a specific patient (see Figure 1). (embs.org)
  • To overcome this problem we develop a method that combines a computational structural modeling (which delivers atomic-resolution structures) with experimental data (which provides information about the population of different states). (lu.se)
  • His research focuses on theoretical and computational neuroscience. (hopkinsmedicine.org)
  • He served on the National Science Foundation computational neuroscience program advisory panel in 2005. (hopkinsmedicine.org)
  • The research in Dr. Zhang's laboratory is focused on theoretical and computational neuroscience. (hopkinsmedicine.org)
  • Analysis and numerical simulation of phytoplankton-nutrient systems with nutrient loss. (uni-trier.de)
  • Numerical simulation of the generalized regularized long wave equation by He's variational iteration method. (uni-trier.de)
  • Modelling, simulating and optimizing such a complex system poses extreme challenges for computational engineering (CE). (tugraz.at)
  • Our research group has aimed to integrate computational modelling with in vitro and in vivo experimentation towards the advancement of chemical mixture toxicology while minimising animal use. (cdc.gov)
  • In the case of complex chemical mixtures and their interactions, the computer-assisted approach of Biochemical Reaction Network Modelling offers a ray of hope. (cdc.gov)
  • The possible linkage between this novel computational methodology and physiologically-based pharmacokinetic (PBPK) modelling could result in a multi-scale computer simulation platform capable of predicting complex pathway interactions and metabolite concentrations at the molecular level up to tissue and organ concentrations at the whole organism level. (cdc.gov)
  • This book presents the 9 lectures delivered at the CCIII Summer Course Computational Social Science and Complex Systems, held as part of the International School of Physics Enrico Fermi in Varenna, Italy, from 16-21 July 2018. (iospress.com)
  • The course had the aim of presenting some of the recent developments in the interdisciplinary fields of computational social science and econophysics to PhD students and young researchers, with lectures focused on recent problems investigated in computational social science. (iospress.com)
  • Addressing some of the basic questions and many of the subtleties of the emerging field of computational social science, the book will be of interest to students, researchers and advanced research professionals alike. (iospress.com)
  • Computational physics, computer science, applied mathematics, statistics and the integration of large data streams are central to scientific discovery and innovation. (lanl.gov)
  • The Computer, Computational, and Statistical Sciences (CCS) Division strengthens the visibility and impact of computer science and computational physics research for the strategic directions at the Laboratory. (lanl.gov)
  • CE is an interdisciplinary scientific discipline with links to applied mathematics, computer science and engineering sciences, and has established itself as the third pillar of gaining knowledge in engineering alongside theory and experiment. (tugraz.at)
  • That is what I said when I was asked whether we would ever see computer science taught in K-12. (acm.org)
  • Since the dotcom bust, there had been a steep and steady decline in undergraduate enrollments in computer science, with no end in sight. (acm.org)
  • The computer science community was wringing its hands, worried about the survival of its departments on campuses. (acm.org)
  • Unlike many of my colleagues, I saw a different, much rosier future for computer science. (acm.org)
  • So, I saw a great opportunity for the computer science community to teach future generations how computer scientists think. (acm.org)
  • Computer science courses are now offered to students not majoring in computer science. (acm.org)
  • These courses are not computer programming courses, but rather focus on core concepts in computer science. (acm.org)
  • And what about computer science enrollments? (acm.org)
  • Second, code.org is a nonprofit organization, started in 2013, dedicated to the mission of providing access to computer science education to all. (acm.org)
  • Third, internationally there is a groundswell of interest in teaching computer science at the K-12 level. (acm.org)
  • The combination of computer science and physics was highly beneficial to me, as I gained proficiency in various programming languages/environments such as C++, C#, Mathematica, and Proteus. (southampton.ac.uk)
  • Nigel Gilbert has a Distinguished Chair in Computational Social Science at the University of Surrey. (surrey.ac.uk)
  • His research and teaching interests have reflected his continuing interest in both sociology and computer science (and engineering more widely). (surrey.ac.uk)
  • Researchers and scientists from the fields of biology, computer science, mathematics, statistics, and physics are invited to share their developments and new techniques in the fields of Biometrics and Bioinformatics. (ourglocal.com)
  • Epstein J (1999) Agent-based computational models and generative social science. (springer.com)
  • Le Sar R (2014) Introduction to computational materials science. (springer.com)
  • Upon completion of their Master's curricula, students obtain an EPFL Master of Science MSc in Computational Science and Engineering . (epfl.ch)
  • Accordingly, it is mostly philosophers of science who study computer simulation. (oxfordbibliographies.com)
  • Their focus has been on the epistemology of computer simulation: They study how computer simulations are embedded in, and change, the workings of science. (oxfordbibliographies.com)
  • 4) To what extent are computer simulations novel in science and what are the consequences for our philosophical picture of science? (oxfordbibliographies.com)
  • The last question is pressing because well-established positions in philosophy of science, e.g., falsificationism, Bayesianism, and Kuhn's position, have been developed without reference to computer simulation. (oxfordbibliographies.com)
  • The focus is entirely on philosophical appraisals of simulations within science. (oxfordbibliographies.com)
  • Simulation ideally bridges the gap of experiment and traditional theory by taking advantage of state-of-the-art development in applied mathematics, computer science, and high performance computers. (inria.fr)
  • This effort is crucial to develop the expertise and skills in hot plasma physics as well as in applied mathematics and computer science that are mandatory to reach international recognition and play a role in the physics of ITER when operating. (inria.fr)
  • In particular, the plasma science community has developed advanced codes for which computer runtime scales quite well with the number of processors up to thousands cores. (inria.fr)
  • On this interdisciplinary education, you gain in-depth knowledge in the area of ​​computational science, but you also take advanced courses that build on your natural science subject knowledge from your bachelor's degree. (lu.se)
  • You learn to study various scientific processes and how computational science can contribute to the development of knowledge in society. (lu.se)
  • Computational modeling is a process that uses computers to simulate and study complex systems using math, physics, and computer science. (cdc.gov)
  • ATSDR's Simulation Science Section uses computational modeling to support a variety of public health research projects and initiatives focused on protecting the health of people and communities. (cdc.gov)
  • The Simulation Science Section collaborates with public health professionals, health assessors at CDC and state health departments, emergency response teams, and academic researchers at colleges and universities. (cdc.gov)
  • If you're interested in collaborating with ATSDR's Simulation Science Section, or if you'd like to use computational modeling in your research project or initiative, contact Simulation Science Section Chief Patricia Ruiz at [email protected] . (cdc.gov)
  • Read annual reports about simulation science at ATSDR. (cdc.gov)
  • Classical approximations to the potential energy surface are used, typically with molecular mechanics force fields, as they are computationally less intensive than electronic calculations, to enable longer simulations of molecular dynamics. (wikipedia.org)
  • Kadau K, Germann T, Lomdahl P (2004) Large-scale molecular dynamics simulation of 19 billion particles. (springer.com)
  • Groups repeated their simulations using a geometry reconstructed from a micro-computed tomography (CT) scan of the physical model with the measured flow rates and fluid properties. (nih.gov)
  • A novel method for a moving mesh is presented in the simulation of a changing geometry with variable openings using a multi-dimensional CFD code. (inderscience.com)
  • 2010 3rd International Conference on Computer Modeling and Simulation (ICCMS 2011) is the premier forum for the presentation of technological advances and research results in the fields of Computer Modeling and Simulation. (wikicfp.com)
  • ICCMS 2011 will bring together leading engineers and scientists in Computer Modeling and Simulation from around the world. (wikicfp.com)
  • B.N. Jiang, The Least-Squares Finite Element Method: Theory and Applications in Computational Fluid Dynamics and Electromagnetics, Springer, 1998. (crossref.org)
  • Experimental results compared well with model predictions based on a computational fluid dynamics fire dynamics simulator. (cdc.gov)
  • The performance of the presented grid generation procedure is superior to the performance of the GPU-accelerated flow field computations per time step which allows efficient fluid-structure interaction simulations, without noticeable performance loss due to the dynamic grid update. (cambridge.org)
  • Sooner or later, scientists and engineers of all kinds would recognize the power of computational abstractions, such as algorithms, data types, and state machines. (acm.org)
  • These skills allowed me to implement real-time computations and simulations for solving physical problems. (southampton.ac.uk)
  • Computer simulations of electrical activity in cardiac tissue offer increasingly detailed insight into these phenomena, providing a view of cellular-level activity on the scale of a whole tissue wall. (scienceopen.com)
  • Applications are invited for two postdoctoral positions to develop computational approaches to study (1) the phenomena of liquid-liquid phase separation of heterogenous mixtures of nucleic acids and proteins occurring inside the Cell nucleus and (2) the organization of chromatin with subnucleosome resolution inside megabase scale domains. (lu.se)
  • Graduates gain an outstanding combination of computer simulation, modeling and applied mathematics techniques and enhance their knowledge in chosen application areas, enabling them to address tomorrow's computational challenges in industry. (epfl.ch)
  • Sebastian Schöps (Head of Computational Electromagnetics at TU Darmstadt ) and Annette Mütze ( Electric Drives and Machines Institute at TU Graz ), spokesperson for the German and Austrian sides respectively, now want to make use of this potential and achieve a paradigm shift with the research work towards new integrated simulation and design approaches. (tugraz.at)
  • The timely running of computational models of cardiac tissue is increasingly dependant on the effective use of High Performance Computing (HPC), i.e. systems with parallel processors. (scienceopen.com)
  • Current state of the art cardiac simulation tools are limited either by the availability of modern, detailed models, or by their hardware portability or ease of use. (scienceopen.com)
  • Biophysical computational models of the heart provide a quantitative framework for mapping changes in anatomy to whole heart function. (plos.org)
  • This highlights the need to have high fidelity anatomical models in cardiac simulations and demonstrates that subtle changes in cardiac anatomy can have a large impact on cardiac function. (plos.org)
  • Automatically building customized circuit-based simulation models using symbolic computing. (uni-trier.de)
  • she's also interested in computational models and computer simulations. (cnr.it)
  • An important problem of speech segmentation models which is emphasised is the evaluation of computer simulations. (uni-stuttgart.de)
  • Simulation technology also offers the potential to directly study theoretical models and the interactions of their components. (uni-stuttgart.de)
  • The readily available pre-procedural medical image data can also be employed for patient-specific simulation of therapeutic interventions based on computational models. (embs.org)
  • His research team uses mathematical analysis and computer simulations to study the nervous system at multiple levels, from realistic biophysical models to simplified neuronal networks. (hopkinsmedicine.org)
  • Humphreys P, Imbert C (eds) (2010) Models, simulations and representations. (springer.com)
  • and the effective integration of this sophisticated behavioral information into computational epidemiological models. (gla.ac.uk)
  • Mental logic, mental models, and computer simulations of human reasoning. (bvsalud.org)
  • Rarefied Gas Dynamics: Theory and Simulations, Vol. 159 of Prog. (crossref.org)
  • The approved coordinated programme with the long title 'Computational Electrical Machine Laboratory. (tugraz.at)
  • Building on research in human perception, our visualization researchers are exploring how to best emphasize features within extremely large simulations such as MPAS, so that important information is quickly and succinctly communicated to scientists. (lanl.gov)
  • Abraham F, Broughton J, Bernstein N, Kaxiras E (1998) Spanning the length scales in dynamic simulation. (springer.com)
  • Bulatov VU, Abraham F, Kubin L, Devrince B, Yip S (1998) Connecting atomistic and mesoscale simulations of crystal plasticity. (springer.com)
  • Among these are in particular computational psychology and cognitive sciences. (uni-stuttgart.de)
  • Nowadays, the use of computer simulations is widespread, in particular in education and in research in the natural and social sciences. (oxfordbibliographies.com)
  • This paper presents a fast surface voxelization technique for the mapping of tessellated triangular surface meshes to uniform and structured grids that provide a basis for CFD simulations with the lattice Boltzmann method (LBM). (cambridge.org)
  • He completed postdoctoral training in computational neurobiology at the Salk Institute for Biological Studies in La Jolla, California. (hopkinsmedicine.org)
  • This paper presents a roadmap for the development of Beatbox , a computer simulation environment for computational biology of the heart-an adaptable and extensible framework with which High Performance Computing may be harnessed by researchers. (scienceopen.com)
  • That is the conclusion of an international team of researchers based on computer simulations of three black holes orbiting each other. (phys.org)
  • Due to the COVID-19 pandemic, student researchers this summer participated in the programs remotely and focused on computational research. (broadinstitute.org)
  • Computational modeling helps researchers gain insight into public health issues and efficiently find solutions . (cdc.gov)
  • With computational modeling, researchers can evaluate thousands of hazardous substances to identify potential health risks quickly and inexpensively. (cdc.gov)
  • Discusses a study that used a CFD program (fire dynamics simulator) based on large eddy simulations (LES) to model floor-level fires in a ventilated tunnel. (cdc.gov)
  • However, the associated challenge of closing the gap between idealized (largely empirically-based) modeling and high-end first principles based simulations of mostly individual plasma dynamics is formidable. (inria.fr)
  • Significant recent progress in simulations of fine-scale turbulence and in large-scale dynamics of magnetically confined plasmas has been enabled by access to terascale supercomputers. (inria.fr)
  • In the future, the Technical University of Darmstadt (TU Darmstadt) and Graz University of Technology (TU Graz) will deepen and advance their joint research work on the simulation of electrical machines here. (tugraz.at)
  • He is Director of the Centre for Research in Social Simulation , Director of the Centre for the Evaluation of Complexity Across the Nexus (CECAN), and Director of the University's Institute of Advanced Studies . (surrey.ac.uk)
  • He proposes to use computer simulation technology to design and evaluate the human interactive robots and is now pushing new research field called computational robotics which will introduce supercomputer in studying super redundant biologic motor control functions and human-robot interface. (who.int)
  • Machine learning, artificial neural networks and AI technologies are developing rapidly, especially in image analysis and computer vision, where LTH has one of Sweden's strongest research groups. (lu.se)
  • The computational phantom represents a valuable platform to study motion management strategies in extra-cranial MRI-guided radiotherapy, where the effects of spatial distortions can be modeled on synthetic images in a virtual environment. (nih.gov)
  • His team is currently engaged in mathematical analysis and computer simulations to study the nervous system at multiple levels. (hopkinsmedicine.org)
  • Flocculated Laponite-PEG/PEO dispersions with monovalent salt, a SAXS and simulation study. (lu.se)
  • This study was conducted at the Greens Creek Mine, which is typical of many VMS-type deposits throughout southeast Alaska , and served as a case history for computer modeling and structural analysis. (cdc.gov)
  • Although considerable progress has been made in using experimental and computational techniques to determine start and final structural states, we have a limited understanding of what happens in between. (lu.se)
  • With the development of efficient computer technology in the 1940s, the solutions of elaborate wave equations for complex atomic systems began to be a realizable objective. (wikipedia.org)
  • Computer simulations became possible with the advent of the digital computer in the 1940s. (oxfordbibliographies.com)
  • If all goes well in the simulation, humans can learn from the outputs how the system under consideration evolves with time. (oxfordbibliographies.com)
  • A single time step from an MPAS (Model for Prediction Across Scales) simulation, showing the temperature of the ocean. (lanl.gov)
  • typically, they discuss the very notion of computer simulation, distinguish different kinds of simulations, and survey the relevant philosophical debates, e.g., about the novelty of simulation or about its relation to experiment. (oxfordbibliographies.com)
  • The rapid, unprecedented increase in the availability of relevant data from various digital sources creates considerable technical and computational challenges. (plos.org)
  • Many of these challenges currently still involve considerable user interaction or computational time. (embs.org)
  • Every other engineering discipline has built modern computational tools: for computer aided design, simulation and testing, and for manufacturing. (oreilly.com)
  • Cao W, Chen S-L, Zhang F, Wu K, Yang Y, Chang YA, Schmid-Fetzer R, Oates WA (2009) PANDAT Software with PanEngine, PanOptimizer and PanPrecipitation for multi-component phase diagram calculation and materials property simulation. (springer.com)
  • Hernandez VS, Murr LE, Anchondo IA (2006) Experimental observations and computer simulations for metallic projectile fragmentation and impact crater development in thick metal targets. (springer.com)
  • There is a special interest in applicants with extensive expertise in large scale simulations using LAMMPS. (lu.se)
  • After all, computers were already used for simulation of large, complex, physical and natural systems. (acm.org)
  • Computer simulation is described as a comprehensive method for studying materials and materials systems. (springer.com)
  • It provides you with a powerful framework to digitalize energy systems by using AI, machine learning, simulations, digital twins and sheds light on cyber security matters. (edx.org)
  • Finally, model results must be appropriately visualized for the treating physician, the system must be integrated into the clinical workflow, and the computer simulation must be validated, which ultimately means comparing predicted to actual outcomes in treated patients. (embs.org)
  • The workflows comparing the old to the new simulation workflow using ParaView Catalyst can be seen in the figure below. (kitware.com)
  • Distributed computing techniques allow hundreds, or even thousands, of computer nodes to participate in a single simulation. (kitware.com)
  • Em: Sun, R. (Ed.), Cambridge Handbook of Computational Cognitive Modeling (pp. 339-358). (bvsalud.org)