Results 31 to 40 of about 23,606 (263)
Variational and diffusion quantum Monte Carlo calculations with the CASINO code [PDF]
The Journal of Chemical Physics, 2020 We present an overview of the variational and diffusion quantum Monte Carlo methods as implemented in the casino program. We particularly focus on developments made in the last decade, describing state-of-the-art quantum Monte Carlo algorithms and software and discussing their strengths and weaknesses. We review a range of recent applications of casino.
R. J. Needs +4 more
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World Journal of Nuclear Medicine, 2017 The specific absorbed fraction (SAF) of energy is an essential element of internal dose assessment. Here reported a set of SAFs calculated for selected organs of a human voxel-based phantom.
Ruhollah Ghahraman Asl +5 more
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Implementing a Simulation Study Using Multiple Software Packages for Structural Equation Modeling
SAGE Open, 2015 A Monte Carlo simulation study is an essential tool for evaluating the behavior of various quantitative methods including structural equation modeling (SEM) under various conditions.
Sunbok Lee
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Portable LQCD Monte Carlo code using OpenACC [PDF]
EPJ Web of Conferences, 2018 Varying from multi-core CPU processors to many-core GPUs, the present scenario of HPC architectures is extremely heterogeneous. In this context, code portability is increasingly important for easy maintainability of applications; this is relevant in scientific computing where code changes are numerous and frequent.
Bonati, Claudio +8 more
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Transcripts enriched in codons that trigger P‐site tRNA‐mediated mRNA decay possess stable mRNA
FEBS Open Bio, EarlyView.PTMD codons were first described by Mendel et al. as mediators of an mRNA decay pathway dependent on the human protein CNOT3, homologous to yeast Not5. Our findings confirm that PTMD codons destabilize transcripts; however, unlike in yeast, the human pathway specifically targets and slightly destabilizes primarily stable mRNAs.
Rodolfo Lopes Carneiro +1 more
wiley +1 more source
FEBS Open Bio, EarlyView.Biophysical characterisation shows that NanX, a membrane transport protein from the major facilitator superfamily (MFS), forms both monomers and dimers after purification. AlphaFold modelling and substrate docking provide information on residues likely involved in substrate recognition for NanX and another MFS member, NanT.
Michael C. Newton‐Vesty +13 more
wiley +1 more source
Science and Technology of Nuclear Installations, 2011 Monte Carlo neutron transport codes are usually used to perform criticality calculations and to solve shielding problems due to their capability to model complex systems without major approximations.
Diego Ferraro, Eduardo Villarino
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Annals of Clinical and Translational Neurology, EarlyView.ABSTRACT Introduction Glucagon‐like peptide‐1 receptor agonists (GLP‐1 RAs) have demonstrated significant weight‐reducing effects and may offer benefits in idiopathic intracranial hypertension (IIH); however, recent concerns about the risk of non‐arteritic anterior ischemic optic neuropathy (NAION) have emerged.
Faisal A. Al‐Harbi +9 more
wiley +1 more source
Neutron clustering in Monte Carlo iterated-source calculations
Nuclear Engineering and Technology, 2017 Monte Carlo neutron transport codes generally use the method of successive generations to converge the fission source distribution to—and then maintain it at—the fundamental mode.
Thomas M. Sutton, Anudha Mittal
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A MONTE CARLO CODE FOR THE TRANSPORT OF NEUTRONS [PDF]
, 1959 A Monte Carlo code for the BM 704 computer was written to study the transport of neutrons in a uniform heterogeneous lattice of cylindrical fuel assemblies. Models of the geometric and physical processes are used to obtain the neutron age and migration area; the flux as a function of position, energy, and direction; and absorption data from which ...
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