بدائل البحث:
algorithm python » algorithm within (توسيع البحث), algorithms within (توسيع البحث), algorithm both (توسيع البحث)
python function » protein function (توسيع البحث)
model reaction » model reduction (توسيع البحث), model prediction (توسيع البحث), model selection (توسيع البحث)
algorithm python » algorithm within (توسيع البحث), algorithms within (توسيع البحث), algorithm both (توسيع البحث)
python function » protein function (توسيع البحث)
model reaction » model reduction (توسيع البحث), model prediction (توسيع البحث), model selection (توسيع البحث)
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Python-Based Algorithm for Estimating NRTL Model Parameters with UNIFAC Model Simulation Results
منشور في 2025"…This algorithm conducts a series of procedures: (1) fragmentation of the molecules into functional groups from SMILES, (2) calculation of activity coefficients under predetermined temperature and mole fraction conditions by employing universal quasi-chemical functional group activity coefficient (UNIFAC) model, and (3) regression of NRTL model parameters by employing UNIFAC model simulation results in the differential evolution algorithm (DEA) and Nelder–Mead method (NMM). …"
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<b>Opti2Phase</b>: Python scripts for two-stage focal reducer
منشور في 2025"…</li></ul><p dir="ltr">The scripts rely on the following Python packages. Where available, repository links are provided:</p><ol><li><b>NumPy</b>, version 1.22.1</li><li><b>SciPy</b>, version 1.7.3</li><li><b>PyGAD</b>, version 3.0.1 — https://pygad.readthedocs.io/en/latest/#</li><li><b>bees-algorithm</b>, version 1.0.2 — https://pypi.org/project/bees-algorithm</li><li><b>KrakenOS</b>, version 1.0.0.19 — https://github.com/Garchupiter/Kraken-Optical-Simulator</li><li><b>matplotlib</b>, version 3.5.2</li></ol><p dir="ltr">All scripts are modular and organized to reflect the design stages described in the manuscript.…"
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Model reactions.
منشور في 2024"…<p>A: There are 11 reactions considered in the model: 5 involving unbinding, degradation, or exposure (non-crawling reactions), and 6 crawling reactions (4 within the same protofibril and 2 to a neighboring protofibril). …"
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Gillespie algorithm for the autocatalytic chemical reaction network from Asymmetric autocatalytic reactions and their stationary distribution
منشور في 2024"…Mathematica code for the GIllespie algorithm used to simulate the continuous Markov chain model of the autocatalytic reaction network…"
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A Python Package for the Localization of Protein Modifications in Mass Spectrometry Data
منشور في 2022الموضوعات: -
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Python implementation of the Trajectory Adaptive Multilevel Sampling algorithm for rare events and improvements
منشور في 2021"…<div>This directory contains Python 3 scripts implementing the Trajectory Adaptive Multilevel Sampling algorithm (TAMS), a variant of Adaptive Multilevel Splitting (AMS), for the study of rare events. …"
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Supervised Machine Learning Algorithms for Predicting Rate Constants of Ozone Reaction with Micropollutants
منشور في 2022"…In this work, several supervised machine learning (ML) algorithms, including multiple linear regression (MLR), support vector machine with radial basis function kernels (SVM-RBF), decision tree (DT), random forest (RF), and deep neutral network (DNN) methods, were used to develop quantitative structure–property relationship (QSPR) models for the estimation of log <i>k</i><sub>O3</sub>. …"
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EFGs: A Complete and Accurate Implementation of Ertl’s Functional Group Detection Algorithm in RDKit
منشور في 2025"…In this paper, a new RDKit/Python implementation of the algorithm is described, that is both accurate and complete. …"
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The optimal solution set of NYN by using different algorithms.
منشور في 2022الموضوعات: "…evolutionary genetic algorithm…"
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The optimal solution set of HN by using different algorithms.
منشور في 2022الموضوعات: "…evolutionary genetic algorithm…"
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FAR-1: A Fast Integer Reduction Algorithm Compared to Collatz and Half-Collatz
منشور في 2025الموضوعات: