EFGs: A Complete and Accurate Implementation of Ertl’s Functional Group Detection Algorithm in RDKit حسب Gonzalo Colmenarejo (650249)

"…In medicinal chemistry, they are the basis for analyzing ligand–biomacromolecule interactions. Ertl’s algorithm is an approach to extract functional groups in arbitrary organic molecules that does not depend on predefined libraries of functional groups. …"

Python-Based Algorithm for Estimating NRTL Model Parameters with UNIFAC Model Simulation Results حسب Se-Hee Jo (20554623)

الموضوعات: "…differential evolution algorithm…"

<b>Opti2Phase</b>: Python scripts for two-stage focal reducer حسب Morgan Najera (21540776)

الموضوعات:

FAR-1: A Fast Integer Reduction Algorithm Compared to Collatz and Half-Collatz حسب Faizan Ali (21689861)

الموضوعات:

Reward function related parameters. حسب Honglei Pang (22693724)

الموضوعات:

Parameters to configure the multi-staged vascularization using the PDCCO algorithm. حسب Eduardo G. Zilves (22209247)

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

Optimization Performance Comparison of Metaheuristic Algorithms. حسب Xie Qiu (13243770)

Reagents, software, and algorithms used in the study with their sources for result reproduction. حسب Aanchal Yadav (14206853)

Explained variance ration of the PCA algorithm. حسب Abeer Aljohani (18497914)

الموضوعات:

Code snippets to add user-specific custom functionality in PyNoetic. حسب Gursimran Singh (575288)

الموضوعات:

A detailed process of iterative simulation coupled with bone density algorithm; (a) a function of stimulus and related bone density changes, and (b) iterative calculations of finite element analysis coupled with user’s subroutine for changes in bone density. حسب Hassan Mehboob (8960273)

"…<p>A detailed process of iterative simulation coupled with bone density algorithm; (a) a function of stimulus and related bone density changes, and (b) iterative calculations of finite element analysis coupled with user’s subroutine for changes in bone density.…"

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

الموضوعات:

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

الموضوعات:

Function <i>χ</i>_<i>opt</i> superimposed with the phase-field function indicating the channel geometry. حسب Martina Bukač (20161460)

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

الموضوعات:

<b>Algorithm Pseudocode</b> حسب Yibin Zhao (22425801)

The phase-field function for three different network configurations considered in this work. حسب Martina Bukač (20161460)

Workflow of our study to evaluate the performance of GNNs compared to benchmark algorithms. حسب Daniel Walke (21680915)

PyNoetic’s classification module supports a range of popular and widely used ML classification models with just a single line of function call. حسب Gursimran Singh (575288)

الموضوعات: