Cost function calculated by SA with different hyperparameters. حسب Takuro Matsuta (21608505)

الموضوعات: "…currently available algorithms…"

Modular architecture design of PyNoetic showing all its constituent functions. حسب Gursimran Singh (575288)

الموضوعات:

Adaptive H-REMD simulation algorithm. حسب Danial Pourjafar-Dehkordi (7165523)

The workflow used to analyze imbalanced and balanced sequences. حسب Solomon Shiferaw Beyene (9143178)

Performances of Naïve Bayes (NB), Multilayer Perceptron (MLP), Random Forest (RF), Gradient Boosting (GB), Support Vector Machine (SVM) and K- Nearest Neighbors (KNN). حسب Solomon Shiferaw Beyene (9143178)

Accuracy, sensitivity, specificity and F-score. حسب Solomon Shiferaw Beyene (9143178)

The figures showed a comparison of the balanced and imbalanced sequences and performance of classifiers. حسب Solomon Shiferaw Beyene (9143178)

Multidimensional Morse/Long-Range Potential Energy Surface and Predicted Rotational Spectra of the CH₄–N₂ Complex حسب Xiao-Long Zhang (299838)

الموضوعات:

A Scalable Route to First-Order Response Properties with Correlated Sampling Phaseless Auxiliary-Field Quantum Monte Carlo حسب Leon Otis (20898157)

الموضوعات:

Calculation of Quantum Chemical Two-Electron Integrals by Applying Compiler Technology on GPU حسب Gábor János Tornai (7423829)

"…In this article, we present an effective approach to calculate quantum chemical two-electron integrals over basis sets consisting of Gaussian-type basis functions on graphical processing unit (GPU). …"

Calculation of Quantum Chemical Two-Electron Integrals by Applying Compiler Technology on GPU حسب Gábor János Tornai (7423829)

"…In this article, we present an effective approach to calculate quantum chemical two-electron integrals over basis sets consisting of Gaussian-type basis functions on graphical processing unit (GPU). …"

Optimum feature set for classification using both core and margin information utilizing GLCM, GRLM, and GLSZM texture methods and SVM-RBF classification algorithm. حسب Laurentius O. Osapoetra (9931759)

Comparison of PyNoetic’s functionality for BCI design with other existing state-of-the-art frameworks. حسب Gursimran Singh (575288)

الموضوعات:

A Quadratic Pair Atomic Resolution of the Identity Based SOS-AO-MP2 Algorithm Using Slater Type Orbitals حسب Arno Förster (8356044)

الموضوعات:

Novel Computational Chemistry Infrastructure for Simulating Astatide in Water: From Basis Sets to Force Fields Using Particle Swarm Optimization حسب Kennet J. Rueda Espinosa (17328825)

"…In particular, we focus on developing an accurate force field for At^– in water based on reliable relativistic density functional theory (DFT) calculations. To ensure the reliability of such calculations, we design novel basis sets for relativistic DFT, via the particle swarm optimization algorithm to optimize the coefficients of the new basis sets and the polarization-consistent basis set idea’s extension to heavy elements to eliminate the basis set error from DFT calculations. …"

A comparison between the static Python-based visualizations of the p65 activity in activated fibroblasts and the dynamic, HTML-based visualizations that use these same reduction me... حسب Hector Torres (11708207)

Overview of functionality supported by PyNoetic and its various modules, including the live analysis and programmable flowchart. حسب Gursimran Singh (575288)

الموضوعات:

Cost functions implemented in Neuroptimus. حسب Máté Mohácsi (20469514)

2lpiRNApred: a two-layered integrated algorithm for identifying piRNAs and their functions based on LFE-GM feature selection حسب Yun Zuo (8541492)

"…Five feature extraction strategies, namely, Kmer, General parallel correlation pseudo-dinucleotide composition, General series correlation pseudo-dinucleotide composition, Normalized Moreau–Broto autocorrelation, and Geary autocorrelation, and two types of classifier, Sparse Representation Classifier (SRC) and support vector machine with Mahalanobis distance-based radial basis function (SVMMDRBF), were used to construct a two-layered integrated classifier algorithm, 2lpiRNApred. …"

Benchmark function information. حسب Hao Yang (328526)