608 research outputs found

    A new statistical solution to the generality problem

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    The Generality Problem is widely recognized to be a serious problem for reliabilist theories of justification. James R. Beebe's Statistical Solution is one of only a handful of attempted solutions that has garnered serious attention in the literature. In their recent response to Beebe, Julien Dutant and Erik J. Olsson successfully refute Beebe's Statistical Solution. This paper presents a New Statistical Solution that countenances Dutant and Olsson's objections, dodges the serious problems that trouble rival solutions, and retains the theoretical virtues that made Beebe's solution so attractive in the first place. There indeed exists a principled, rigorous, conceptually sparse, and plausible solution to the Generality Problem: it is the New Statistical Solution

    Generating Molecular Fragmentation Graphs with Autoregressive Neural Networks

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    The accurate prediction of tandem mass spectra from molecular structures has the potential to unlock new metabolomic discoveries by augmenting the community's libraries of experimental reference standards. Cheminformatic spectrum prediction strategies use a "bond-breaking" framework to iteratively simulate mass spectrum fragmentations, but these methods are (a) slow, due to the need to exhaustively and combinatorially break molecules and (b) inaccurate, as they often rely upon heuristics to predict the intensity of each resulting fragment; neural network alternatives mitigate computational cost but are black-box and not inherently more accurate. We introduce a physically-grounded neural approach that learns to predict each breakage event and score the most relevant subset of molecular fragments quickly and accurately. We evaluate our model by predicting spectra from both public and private standard libraries, demonstrating that our hybrid approach offers state of the art prediction accuracy, improved metabolite identification from a database of candidates, and higher interpretability when compared to previous breakage methods and black box neural networks. The grounding of our approach in physical fragmentation events shows especially high promise for elucidating natural product molecules with more complex scaffolds.Comment: 11 pages, 17 pages with references and appendix, 5 figure

    APPLICATION OF DISCRETE BASIS SET METHODS TO THE DIRAC EQUATION.

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    A variational discrete representation of the relativistic energy spectrum of an electron in a Coulomb field is constructed. It is shown that by a proper choice of the variational basis set, the eigenvalues satisfy a generalized Hylleraas-Undheim theorem. A number of relativistic sum rules which can be evaluated exactly are calculated by means of the basis set to demonstrate that the variational solutions obtained by the diagonalization of the Dirac Hamiltonian with a Coulomb potential yield a discrete representation of the hydrogenic spectrum including both the positive and negative continua. The results strongly suggest that the set of relativistic variational eigenvectors and eigenvalues can be used to construct a discrete representation of the Dirac-Green\u27s function. As applications, the relativistic basis set is used to calculate relativistic values for dipole polarizabilities, electric dipole oscillator strength sums for the ground state with and without retardation, and two-photon decay rates for the metastable 2s(, 1/2) state in hydrogenic ions. The two-photon decay rates differ from previous calculations due to the inclusion of higher order retardation corrections. Our oscillator strength sums from the ground state appear to be much more accurate than earlier calculations. The oscillator strength densities in the continuum are used to calculate photoionization cross-sections by a Stieltjes imaging technique.Dept. of Physics. Paper copy at Leddy Library: Theses & Major Papers - Basement, West Bldg. / Call Number: Thesis1981 .G6424. Source: Dissertation Abstracts International, Volume: 42-03, Section: B, page: 1057. Thesis (Ph.D.)--University of Windsor (Canada), 1981

    A physical approach to spherical stars.

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    Dept. of Physics. Paper copy at Leddy Library: Theses & Major Papers - Basement, West Bldg. / Call Number: Thesis1977 .G643. Source: Masters Abstracts International, Volume: 40-07, page: . Thesis (M.Sc.)--University of Windsor (Canada), 1977

    MIST-CF: Chemical formula inference from tandem mass spectra

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    Chemical formula annotation for tandem mass spectrometry (MS/MS) data is the first step toward structurally elucidating unknown metabolites. While great strides have been made toward solving this problem, the current state-of-the-art method depends on time-intensive, proprietary, and expert-parameterized fragmentation tree construction and scoring. In this work we extend our previous spectrum Transformer methodology into an energy based modeling framework, MIST-CF, for learning to rank chemical formula and adduct assignments given an unannotated MS/MS spectrum. Importantly, MIST-CF learns in a data dependent fashion using a Formula Transformer neural network architecture and circumvents the need for fragmentation tree construction. We train and evaluate our model on a large open-access database, showing an absolute improvement of 10% top 1 accuracy over other neural network architectures. We further validate our approach on the CASMI2022 challenge dataset, achieving nearly equivalent performance to the winning entry within the positive mode category without any manual curation or post-processing of our results. These results demonstrate an exciting strategy to more powerfully leverage MS2 fragment peaks for predicting MS1 precursor chemical formula with data driven learning

    Chess Robot

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    ME450 Capstone Design and Manufacturing Experience: Winter 2021The Chess Robot is designed to be an autonomous robotic arm that is able to compete in a chess match against a human. The robot moves their own pieces and captures the opponent’s pieces in efforts to win a standard game of chess. Robotic arms that play chess have been created before, but are either industrial grade and expensive or very cheap/homemade and slow. This project aimed to create a functional chess robot that maximizes speed at a relatively low cost. It was also designed with potential for mass manufacturing in mind. With additional design and development, the skill of the robot should be easily changed, since the software is easily customized; thus, as the player improves, so will the robot. There will also be an opportunity to play chess against other humans through two intermediary robots or for one player to play while making use of an online chess platform. This feature, if fully developed, will enable chess instructors to play with children and not be limited by geographical proximity, further expanding the reach of chess education.Student Sponsor: UM Mechanical Engineering departmenthttp://deepblue.lib.umich.edu/bitstream/2027.42/167650/1/Team_5-Chess_Robot.pd
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