المؤلفون: Kenney Ki Lee Lau, Kenny Yat Hong Kwan, Jason Pui Yin Cheung, Karlen Ka Pui Law, Arnold Yu Lok Wong, Daniel Hung Kay Chow, Kenneth Man Chee Cheung

المصدر: Scientific Reports, Vol 14, Iss 1, Pp 1-9 (2024)

مصطلحات موضوعية: Proprioception, Position sense, Repositioning errors, Absolute errors, Proprioceptive deficits, Normative values, Medicine, Science

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2045-2322

URL الوصول: https://doaj.org/article/f1aa3c956e504ed0bc9bbc35d136cc67

المؤلفون: Waleed Al-Ashtari

المصدر: Journal of Engineering, Vol 30, Iss 10 (2024)

مصطلحات موضوعية: PID controller, Non-linear system, Runge-Kutta technique, Simulink model, Integral of the Absolute Errors (IAE), Engineering (General). Civil engineering (General), TA1-2040

وصف الملف: electronic resource

Relation: https://www.joe.uobaghdad.edu.iq/index.php/main/article/view/3476; https://doaj.org/toc/1726-4073; https://doaj.org/toc/2520-3339

URL الوصول: https://doaj.org/article/e2720b16c19a4cdeb14fb8e656870030

المؤلفون: Shah Kamal, Abdeljawad Thabet, Jeelani Mdi Begum, Alqudah Manar A.

المصدر: Open Physics, Vol 21, Iss 1, Pp 15-67 (2023)

مصطلحات موضوعية: shifted jacobi polynomials, matrix equation, numerical results, absolute errors, Physics, QC1-999

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2391-5471

URL الوصول: https://doaj.org/article/2b43b05676054b95a75b7063e266f6bf

المؤلفون: Ritaj Tyagi, Vamsee K. Voora

مصطلحات موضوعية: Biophysics, Biotechnology, Ecology, Cancer, Information Systems not elsewhere classified, nonvalence electronic states, mean absolute errors, dependent polarization function, 24 – 1, superatomic molecular states, random phase approximation, pole polarization models, model combines exact, model also provides, parameter effective one, pole approximation, molecular clusters, level parameter, free one, xc ), time similar, significantly reduces, rapid evaluation, range static, particle potential, particle hamiltonians, hybrid functionals, ea values, computational wall, captures long

Relation: https://figshare.com/articles/journal_contribution/Single-Pole_Polarization_Models_Rapid_Evaluation_of_Electron_Affinities_of_Solvated-Electron_and_Superatomic_Molecular_Anionic_States/25075365

الاتاحة: https://doi.org/10.1021/acs.jpclett.3c03392.s003
https://figshare.com/articles/journal_contribution/Single-Pole_Polarization_Models_Rapid_Evaluation_of_Electron_Affinities_of_Solvated-Electron_and_Superatomic_Molecular_Anionic_States/25075365

المؤلفون: López-Rubio, Ezequiel, Thurnhofer-Hemsi, Karl, Blázquez-Parra, Elidia Beatriz, De-Cózar-Macías, Óscar, Ladrón-de-Guevara-Muñoz, María del Carmen

مصطلحات موضوعية: Ajuste de curvas, Geometría analítica, Parabolic fitting, Geometric curve fitting, Noise, Minimization of absolute errors, Robust estimation

Relation: Ezequiel López-Rubio, Karl Thurnhofer-Hemsi, Elidia Beatriz Blázquez-Parra, Óscar David de Cózar-Macías, M. Carmen Ladrón-de-Guevara-Muñoz, A fast robust geometric fitting method for parabolic curves, Pattern Recognition, Volume 84, 2018, Pages 301-316; https://hdl.handle.net/10630/29017

الاتاحة: https://hdl.handle.net/10630/29017
https://doi.org/10.1016/j.patcog.2018.07.019

المؤلفون: Jinwoong Nam, Charanyadevi Ramasamy, Daniel E. Raser, Gustavo L. Barbosa Couto, Lydia Thies, David Hibbitts, Fuat E. Celik

مصطلحات موضوعية: Biotechnology, Environmental Sciences not elsewhere classified, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, using molecular fingerprints, lower absolute errors, individual carbons within, four molecular descriptors, first key step, extreme gradient boosting, complicated reaction networks, 30 different samplings, hydrocarbon radicals adsorbed, studying surface reactions, 6 , 2 , 111 ), highlighting, 3115 hydrocarbon adsorbates, outperformed linear models, four nonlinear algorithms, developed machine learning, predicting various species, machine learning, hydrocarbon adsorbates, three linear, nonlinear models, surface atoms, various c, total species

Relation: https://figshare.com/articles/journal_contribution/Predicting_the_Enthalpy_of_Hydrocarbon_Radicals_Adsorbed_on_Pt_111_Using_Molecular_Fingerprints_and_Machine_Learning/25429323

الاتاحة: https://doi.org/10.1021/acs.jpcc.3c08227.s001

المؤلفون: Khalid Aasma, Naeem Muhammad Nawaz, Jamal Neelam, Askar Sameh, Ahmad Hijaz

المصدر: Open Physics, Vol 21, Iss 1, Pp 95-105 (2023)

مصطلحات موضوعية: nonlinear, linear, adomian decomposition method, absolute errors, fourteenth order, Physics, QC1-999

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2391-5471

URL الوصول: https://doaj.org/article/1956bca954a043d3971d1959dc75f1ae

المؤلفون: Gbolade O. Kayode, Matthew M. Montemore

مصطلحات موضوعية: Genetics, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, providing significant improvements, multifidelity data sets, mean absolute errors, 10 data points, interpretability machine learning, many possible intermediates, potential catalytic materials, new feature representations, learned chemical environment, despite recent advances, promoting transfer learning, including transfer learning, higher data efficiency, experimental data set, 20 – 0, many different applications, requiring new models, transfer learning, many adsorbates, screen materials, recent years, new models, new application, chemical principles, useful levels, transition states

Relation: https://figshare.com/articles/journal_contribution/Latent_Variable_Machine_Learning_Framework_for_Catalysis_General_Models_Transfer_Learning_and_Interpretability/24871357

الاتاحة: https://doi.org/10.1021/jacsau.3c00419.s001
https://figshare.com/articles/journal_contribution/Latent_Variable_Machine_Learning_Framework_for_Catalysis_General_Models_Transfer_Learning_and_Interpretability/24871357

المؤلفون: Christian Venturella, Christopher Hillenbrand, Jiachen Li, Tianyu Zhu

مصطلحات موضوعية: Biochemistry, Computational Biology, Biological Sciences not elsewhere classified, Mathematical Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, showing accurate predictions, qm9 data sets, predicted highest occupied, kernel ridge regression, high data efficiency, gives direct access, full configuration interaction, field electronic features, enforce rotational invariance, demonstrate good transferability, 44 heavy atoms, predicting green ’, mean absolute errors, energy matrix elements, body green ’, molecular excitation spectra, ml model trained, machine learning many, machine learning, dyson ’, photoemission spectra, molecular systems, ml model, energy matrices

Relation: https://figshare.com/articles/journal_contribution/Machine_Learning_Many-Body_Green_s_Functions_for_Molecular_Excitation_Spectra/24908473

الاتاحة: https://doi.org/10.1021/acs.jctc.3c01146.s001
https://figshare.com/articles/journal_contribution/Machine_Learning_Many-Body_Green_s_Functions_for_Molecular_Excitation_Spectra/24908473

المؤلفون: Peng Xu, Samuel L. Leonard, William O’Brien, Mark S. Gordon

مصطلحات موضوعية: Neuroscience, Pharmacology, Ecology, Environmental Sciences not elsewhere classified, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, tang – toennies, mean absolute errors, localized molecular orbitals, effective fragment potential, adapted perturbation theory, overall correct curvature, interaction energy improves, isotropic disp8 yields, isotropic disp8 contribution, isotropic disp8 component, yield smaller maes, efp dispersion energy, efp dispersion energies, intermolecular overlap matrix, efp dispersion derivation, dispersion interaction, overall agreement, intermolecular overlap, dispersion interactions, dispersion contributions, isotropic r, two forms, short range

Relation: https://figshare.com/articles/journal_contribution/R_sup_8_sup_Dispersion_Interaction_Derivation_and_Application_to_the_Effective_Fragment_Potential_Method/24910555

الاتاحة: https://doi.org/10.1021/acs.jpca.3c05115.s002
https://figshare.com/articles/journal_contribution/R_sup_8_sup_Dispersion_Interaction_Derivation_and_Application_to_the_Effective_Fragment_Potential_Method/24910555

المؤلفون: Clemens Isert (14329094), Jimmy C. Kromann (1926010), Nikolaus Stiefl (1612573), Gisbert Schneider (17096), Richard A. Lewis (535635)

مصطلحات موضوعية: Biotechnology, Sociology, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, substantial computational cost, model failure modes, mean absolute errors, large compound collections, house data sets, certain discovery projects, best performing model, learning curves suggests, training set size, test set error, house data set, existing empirical models, potential use cases, 34 log units, based approach incurs, models directly trained, using calculated log, learn calculated log, values going beyond, full qm calculations, drug lipophilicity lipophilicity, machine learning models, public data set, machine learning, drug lipophilicity

Relation: https://figshare.com/articles/journal_contribution/Machine_Learning_for_Fast_Quantum_Mechanics-Based_Approximation_of_Drug_Lipophilicity/21817370

الاتاحة: https://doi.org/10.1021/acsomega.2c05607.s001

المؤلفون: Mingxue Fu (10745022), Tomasz A. Wesolowski (1540336)

مصطلحات موضوعية: Biophysics, Molecular Biology, Biotechnology, Evolutionary Biology, Ecology, Infectious Diseases, Physical Sciences not elsewhere classified, evaluate different contributions, density embedding theory, average absolute errors, appropriate density expansion, 47 local excitations, specific electron densities, embedded wave functions, >, >), vertical excitation energy, fdet embedding potential, excitation energies drop, >, excitation energy, excitation energies, sub ><, embedded species, embedded electrons, embedded chromophores, embedded chromophore, use state, standard deviations, specific ρ

Relation: https://figshare.com/articles/journal_contribution/Excitation_Energies_of_Embedded_Chromophores_from_Frozen-Density_Embedding_Theory_Using_State-Specific_Electron_Densities_of_the_Environment/21817814

الاتاحة: https://doi.org/10.1021/acs.jpca.2c07747.s001

المؤلفون: Aasma Khalid, A.S.A. Alsubaie, Mustafa Inc, Akmal Rehan, W. Mahmoud, M.S. Osman

المصدر: Results in Physics, Vol 39, Iss , Pp 105726- (2022)

مصطلحات موضوعية: Boundary value problems, Cubic spline, Absolute errors, Central finite difference approximations, Physics, QC1-999

وصف الملف: electronic resource

Relation: http://www.sciencedirect.com/science/article/pii/S2211379722004016; https://doaj.org/toc/2211-3797

URL الوصول: https://doaj.org/article/7cbd39092fcc42658088b5f8bd558b15

المؤلفون: Navnit Jha, Madhav Wagley

المصدر: Mathematics in Applied Sciences and Engineering, Vol 1, Iss 4, Pp 286-308 (2020)

مصطلحات موضوعية: compact scheme, quasi-variable mesh, generalized burgers-huxley equation, generalized burgers-fisher equation, ilkovič’s equation, stability, maximum-absolute-errors, Applied mathematics. Quantitative methods, T57-57.97

وصف الملف: electronic resource

Relation: https://ojs.lib.uwo.ca/index.php/mase/article/view/10837; https://doaj.org/toc/2563-1926

URL الوصول: https://doaj.org/article/0dee6f7c10a8469082038b33dac20533

المؤلفون: Yang Chen, Jinxia Wu, Jie Lan

المصدر: AIMS Mathematics, Vol 5, Iss 6, Pp 7719-7745 (2020)

مصطلحات موضوعية: type-reduction, weighted nagar-bardini algorithms, weighted nie-tan algorithms, weighted begian-melek-mendel algorithms, absolute errors, Mathematics, QA1-939

وصف الملف: electronic resource

Relation: https://www.aimspress.com/article/10.3934/math.2020494/fulltext.html; https://doaj.org/toc/2473-6988

URL الوصول: https://doaj.org/article/6304d24e1f704cccaac269661c097df2

المؤلفون: Yang Chen, Jinxia Wu, Jie Lan

المصدر: AIMS Mathematics, Vol 5, Iss 6, Pp 6149-6168 (2020)

مصطلحات موضوعية: interval type-2 fuzzy logic systems, centroid, reasonable initialization enhanced karnik-mendel (riekm) algorithms, absolute errors, computer simulation, Mathematics, QA1-939

وصف الملف: electronic resource

Relation: https://www.aimspress.com/article/10.3934/math.2020395/fulltext.html; https://doaj.org/toc/2473-6988

URL الوصول: https://doaj.org/article/7ec0332607d54858b3fbcd0cdae82b8b

المؤلفون: Zhang, Xiao-Zhong, Khalid, Aasma, İnç, Mustafa, Rehan, Akmal, Nisar, Kottakkaran Sooppy, Osman, Mohamad

المساهمون: Mühendislik ve Doğa Bilimleri Fakültesi

مصطلحات موضوعية: Boundary Value Problems, Cubic B-Spline, Absolute Errors, Central Finite Difference Approximations

وصف الملف: application/pdf

Relation: https://doi.org/10.1016/j.aej.2022.05.003; Alexandria Engineering Journal; Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı; https://hdl.handle.net/20.500.12445/2263; 61; 12; 15

الاتاحة: https://hdl.handle.net/20.500.12445/2263
https://doi.org/10.1016/j.aej.2022.05.003

المؤلفون: Yuriy A. Abramov (1434262), Bochen Li (5431028), Chao Chang (2607691), Qun Zeng (578055), Guangxu Sun (1603687), Gianpaolo Gobbo (1467925)

مصطلحات موضوعية: Sociology, Plant Biology, Computational Biology, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, virtual crystalline states, systematic scaling error, stable form selection, smallest absolute errors, hartree – fock, five oxalyl dihydrazide, crystal structure prediction, four pharmaceutical compounds, selected popular dft, favorable uncertainty distribution, )/ hmbi predictions, uncertainty distribution, pharmaceutical industry, uncertainty distributions, valuable support, successful applications, relative energies, polymorphs relative, lowest contribution, eight roy, ccsd ­(, benchmarking studies, accurate enough

Relation: https://figshare.com/articles/journal_contribution/Uncertainty_Distribution_of_Crystal_Structure_Prediction/16540179

الاتاحة: https://doi.org/10.1021/acs.cgd.1c00527.s001

المؤلفون: Sergei F. Vyboishchikov (1999156), Alexander A. Voityuk (392678)

مصطلحات موضوعية: Biophysics, Biochemistry, Genetics, Physiology, Pharmacology, Biotechnology, Plant Biology, Computational Biology, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, solvation free energies, noniterative cosmo algorithm, mean absolute errors, 92 different solvents, quickly screen δ, 389 neutral solutes, aqueous solutions estimated, semiempirical method pm7, nonaqueous solutions, neutral molecules, 988 solutes, organic solvents, nonpolar solvents, polar protic, polar aprotic, pm7 approach, molecular geometries, g <, developed method, calculate δ

Relation: https://figshare.com/articles/journal_contribution/Solvation_Free_Energies_for_Aqueous_and_Nonaqueous_Solutions_Computed_Using_PM7_Atomic_Charges/16624638

الاتاحة: https://doi.org/10.1021/acs.jcim.1c00885.s001

المؤلفون: Wataru Sotoyama (6615938)

مصطلحات موضوعية: Biophysics, Biochemistry, Cell Biology, Physiology, Biotechnology, Space Science, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, triplet excited states, reverse intersystem crossing, quite accurate δ, mean absolute errors, 041 ev ), δscf also demonstrated, st , 1 , e <, 055 ev, >< sub, type emitter, tddft ), sufficient accuracy, promising group, photophysical properties, organic light, lying singlet, literature showed, experimental values, excitation energies, emitting diode

Relation: https://figshare.com/articles/journal_contribution/Simulation_of_Low-Lying_Singlet_and_Triplet_Excited_States_of_Multiple-Resonance-Type_Thermally_Activated_Delayed_Fluorescence_Emitters_by_Delta_Self-Consistent_Field_SCF_Method/17105212

الاتاحة: https://doi.org/10.1021/acs.jpca.1c08900.s001