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- Smith, Daniel G. A., et al.
(författare)
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Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine) : Automation and interoperability among computational chemistry programs
- 2021
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Ingår i: Journal of Chemical Physics. - : American Institute of Physics (AIP). - 0021-9606 .- 1089-7690. ; 155:20
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Tidskriftsartikel (refereegranskat)abstract
- Community efforts in the computational molecular sciences (CMS) are evolving toward modular, open, and interoperable interfaces that work with existing community codes to provide more functionality and composability than could be achieved with a single program. The Quantum Chemistry Common Driver and Databases (QCDB) project provides such capability through an application programming interface (API) that facilitates interoperability across multiple quantum chemistry software packages. In tandem with the Molecular Sciences Software Institute and their Quantum Chemistry Archive ecosystem, the unique functionalities of several CMS programs are integrated, including CFOUR, GAMESS, NWChem, OpenMM, Psi4, Qcore, TeraChem, and Turbomole, to provide common computational functions, i.e., energy, gradient, and Hessian computations as well as molecular properties such as atomic charges and vibrational frequency analysis. Both standard users and power users benefit from adopting these APIs as they lower the language barrier of input styles and enable a standard layout of variables and data. These designs allow end-to-end interoperable programming of complex computations and provide best practices options by default.
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- Da Via, C, et al.
(författare)
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Lightwave Analogue Links For LHC Detector Front-ends
- 1994
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Ingår i: Nuclear Instruments & Methods in Physics Research. Section A: Accelerators, Spectrometers, Detectors, and Associated Equipment. - : Elsevier BV. - 0167-5087 .- 0168-9002. ; 344:1, s. 199-211
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Tidskriftsartikel (refereegranskat)abstract
- The requirements on optical links for transferring analog and digital signals from the detector front-ends to the readout electronics at future high-luminosity colliders are reviewed. The advantages of external modulation techniques are discussed. An outline is given of the the R&D programme recently started at CERN by a collaboration involving high-energy physics institutes, optoelectronics research laboratories and industry, in order to develop electro-optic intensity modulator arrays, particularly for analogue applications, and to investigate the feasibility of volume production. The design of multichannel demonstrators in lithium niobate and III-V semiconductor technology is described. Preliminary results of the performance measurements are presented.
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- Hademenos, George J, et al.
(författare)
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A Monte Carlo Investigation of the Dual Photopeak Window Scatter Correction Method
- 1993
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Ingår i: IEEE Transactions on Nuclear Science. - : Institute of Electrical and Electronics Engineers (IEEE). - 0018-9499 .- 1558-1578. ; 40:2, s. 179-185
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Tidskriftsartikel (refereegranskat)abstract
- Results from a Monte Carlo investigation of the dual photopeak window (DPW) scatter correction method are presented for point and extended sources of Tc-99m in both homogeneous and nonhomogeneous attenuating media. The DPW method uses the ratio of counts in two nonoverlapping energy windows within the photopeak region as input to a regression relation. A pixel-by-pixel estimate of the scatter in the summed windows is obtained and subtracted to yield an estimate of the primary. An approximate tenfold decrease in the scatter fraction and an excellent agreement with the shape of the true scatter distribution were observed.
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- Ramsey, S., et al.
(författare)
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Cost-effectiveness analysis alongside clinical trials II - An ISPOR good research practices task force report
- 2015
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Ingår i: Value in Health. - : Wiley: No OnlineOpen / Elsevier: 12 months. - 1098-3015. ; 18:2, s. 161-172
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Tidskriftsartikel (refereegranskat)abstract
- Clinical trials evaluating medicines, medical devices, and procedures now commonly assess the economic value of these interventions. The growing number of prospective clinical/economic trials reflects both widespread interest in economic information for new technologies and the regulatory and reimbursement requirements of many countries that now consider evidence of economic value along with clinical efficacy. As decision makers increasingly demand evidence of economic value for health care interventions, conducting high-quality economic analyses alongside clinical studies is desirable because they broaden the scope of information available on a particular intervention, and can efficiently provide timely information with high internal and, when designed and analyzed properly, reasonable external validity. In 2005, ISPOR published the Good Research Practices for Cost-Effectiveness Analysis Alongside Clinical Trials: The ISPOR RCT-CEA Task Force report. ISPOR initiated an update of the report in 2014 to include the methodological developments over the last 9 years. This report provides updated recommendations reflecting advances in several areas related to trial design, selecting data elements, database design and management, analysis, and reporting of results. Task force members note that trials should be designed to evaluate effectiveness (rather than efficacy) when possible, should include clinical outcome measures, and should obtain health resource use and health state utilities directly from study subjects. Collection of economic data should be fully integrated into the study. An incremental analysis should be conducted with an intention-to-treat approach, complemented by relevant subgroup analyses. Uncertainty should be characterized. Articles should adhere to established standards for reporting results of cost-effectiveness analyses. Economic studies alongside trials are complementary to other evaluations (e.g., modeling studies) as information for decision makers who consider evidence of economic value along with clinical efficacy when making resource allocation decisions.
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- Rastegarfar, Houman, 1983, et al.
(författare)
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TCP Flow Classification and Bandwidth Aggregation in Optically Interconnected Data Center Networks
- 2016
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Ingår i: Journal of Optical Communications and Networking. - : The Optical Society. - 1943-0620 .- 1943-0639. ; 8:10, s. 777-786
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Tidskriftsartikel (refereegranskat)abstract
- Optical functionality is being used to realize new data center architectures that minimize electronic switching overheads, pushing the processing to the edge of the network. A challenge in optically interconnected data center networks is to identify the large, bandwidth-hungry flows ( i.e., elephants) and efficiently establish the optical circuits. Moreover, the amount of optical resources to be provisioned during the network planning phase is a critical design problem. Flow classification accuracy affects the efficiency of optical circuits. Optical channel bandwidth, on the other hand, directly relates to the additive-increase, multiplicative-decrease congestion control mechanism of the transmission control protocol and affects the effective bandwidth allocated to elephant flows. In this paper, we simultaneously investigate the impact of two important mechanisms on data center network performance: traffic flow classification accuracy and optical bandwidth aggregation ( i.e., the consolidation of several low-capacity channels into a single high-capacity one by employing advanced modulation formats for short-reach communications). We develop a discrete-event simulator for a hybrid data center network, enabling the tuning of flow classification parameters. Our simulations indicate that data center performance is highly sensitive to the aggregation level. We could observe up to a 74.5% improvement in network throughput only due to consolidating the optical channel bandwidth. We further noticed that the role of flow classification becomes more pronounced with higher bandwidth per wavelength as well as with more hot-spot traffic. Compared to a random classification benchmark, adaptive flow classification could lead to throughput improvements as large as 54.7%.
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