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algorithm protein » algorithm within (Expand Search), algorithm pre (Expand Search)
algorithm python » algorithm within (Expand Search), algorithms within (Expand Search), algorithm both (Expand Search)
algorithm adl » algorithm maml (Expand Search), algorithm a (Expand Search), algorithm ai (Expand Search)
adl function » a function (Expand Search), model function (Expand Search), cell function (Expand Search)
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2081
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2082
my-home-is-my-secret.zip
Published 2022“…</p> <p><br></p> <p>The material contains two folders; each contains an implementation of the algorithm, one in Java and one in Python.<br> </p> <p><br></p> <p>The Python script includes a function (example()) demonstrating how the mechanism class ('STT') may be used. …”
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2083
Known compounds and new lessons: structural and electronic basis of flavonoid-based bioactivities
Published 2019“…Abbreviations2′HFN-2′</p><p>hydroxy flavonone</p>2D<p>2 dimension</p>3D<p>3 dimension</p>3H7MF<p>3-hydroxy-7-methoxy flavone</p>4′HFN-4′<p>hydroxy flavonone</p>4′MF- 4′<p>methoxy flavone</p>7HFN<p>7-hydroxy flavonone</p>CHARMM<p>Chemistry at Harvard Macromolecular Mechanics</p>COX<p>cyclooxygenase</p>COX-1<p>cyclooxygenase-1</p>COX-2<p>cyclooxygenase-2</p>DM<p>dipole moment</p>DPPH- 2, 2<p>diphenyl-1-picryl hydrazine</p>EA<p>electron affinities</p>EGFR<p>epidermal growth factor receptor</p>E-HOMO<p>Highest occupied molecular orbital energy</p>E-LUMO<p>Lowest unoccupied molecular orbital energy</p>EPA<p>eicosapentaenoic acid</p>FROG2<p>FRee Online druG conformation generation</p>GA<p>Genetic Algorithm</p>GROMACS<p>GROningen MAchine for Chemical Simulations</p>HOMO<p>Highest occupied molecular orbital</p>IP<p>Ionization potential</p>LOMO<p>Lowest unoccupied molecular orbital</p>MD<p>Molecular dynamics</p>MO<p>Molecular orbital</p>NAMD<p>Nanoscale Molecular Dynamics</p>NSAIDs<p>Non-Steroidal Anti Inflammatory Drugs</p>Ns<p>nanoseconds</p>NVE<p>Ensemble-constant-energy, constant-volume, Constant particle ensemble</p>PDB-ID<p>Protein Data Bank Identifier</p>PME<p>Particle Mesh Ewald</p>PyRX<p>Python Prescription</p>RMSD<p>Root-Mean-Square Deviation</p>RMSF<p>Root-Mean-Square Fluctuation</p>RLS<p>reactive lipid species</p>ROS<p>Reactive Oxygen Species</p>SASA<p>solvent accessible surface area</p>SMILES<p>simplified molecular-input line-entry system</p>SOR<p>superoxide anion radical</p>UFF<p>Universal force field</p>VEGF<p>vascular endothelial growth factor</p>VEGFR<p>vascular endothelial growth factor receptor</p>VMD<p>Visual molecular dynamics</p><p></p> <p>hydroxy flavonone</p> <p>2 dimension</p> <p>3 dimension</p> <p>3-hydroxy-7-methoxy flavone</p> <p>hydroxy flavonone</p> <p>methoxy flavone</p> <p>7-hydroxy flavonone</p> <p>Chemistry at Harvard Macromolecular Mechanics</p> <p>cyclooxygenase</p> <p>cyclooxygenase-1</p> <p>cyclooxygenase-2</p> <p>dipole moment</p> <p>diphenyl-1-picryl hydrazine</p> <p>electron affinities</p> <p>epidermal growth factor receptor</p> <p>Highest occupied molecular orbital energy</p> <p>Lowest unoccupied molecular orbital energy</p> <p>eicosapentaenoic acid</p> <p>FRee Online druG conformation generation</p> <p>Genetic Algorithm</p> <p>GROningen MAchine for Chemical Simulations</p> <p>Highest occupied molecular orbital</p> <p>Ionization potential</p> <p>Lowest unoccupied molecular orbital</p> <p>Molecular dynamics</p> <p>Molecular orbital</p> <p>Nanoscale Molecular Dynamics</p> <p>Non-Steroidal Anti Inflammatory Drugs</p> <p>nanoseconds</p> <p>Ensemble-constant-energy, constant-volume, Constant particle ensemble</p> <p>Protein Data Bank Identifier</p> <p>Particle Mesh Ewald</p> <p>Python Prescription</p> <p>Root-Mean-Square Deviation</p> <p>Root-Mean-Square Fluctuation</p> <p>reactive lipid species</p> <p>Reactive Oxygen Species</p> <p>solvent accessible surface area</p> <p>simplified molecular-input line-entry system</p> <p>superoxide anion radical</p> <p>Universal force field</p> <p>vascular endothelial growth factor</p> <p>vascular endothelial growth factor receptor</p> <p>Visual molecular dynamics</p> <p>Communicated by Ramaswamy H. …”
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2084
NanoDB: Research Activity Data Management System
Published 2024“…Cross-Platform Compatibility: Works on Windows, macOS, and Linux. In a Python environment or as an executable. Ease of Implementation: Using the flexibility of the Python framework all the data setup and algorithm can me modified and new functions can be easily added. …”
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2085
PREDICTION OF DEM PARAMETERS OF COATED FERTILIZER PARTICLES BASED ON GA-BP NEURAL NETWORK
Published 2023“…The predicted values matched the expected output values, indicating that the GA-BP neural network can accurately predict the nonlinear function output, and the network predicted output can be approximated as the actual output of the function. …”
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2086
Code and Data for 'Fabrication and testing of lensed fiber optic probes for distance sensing using common path low coherence interferometry'
Published 2025“…Distance Sensing</p><p dir="ltr">Code and data to demonstrate extracting distance sensing data from A-scans and to generate Fig. 8 using the algorithm described in Fig. 7. Functions to generate distance measurements are in 'distance_sensing_utilities.py' and an example of how to use this on data in the 'data' folder is in 'distance_sensing_example.py', which generates Fig 8. …”
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2087
A dynamically changing bistable switch enhances robustness and accuracy of transitions in time and space.
Published 2021“…B) Function used to make the shape of the switch dependent on the total amount of protein, by coupling <i>a</i> to <i>X</i><sub><i>T</i></sub>. …”
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2088
Brain-in-the-Loop Learning for Intelligent Vehicle Decision-Making
Published 2025“…In this paper, we utilize functional near-infrared spectroscopy (fNIRS) signals as real-time human risk-perception feedback to establish a brain-in-the-loop (BiTL) trained artificial intelligence algorithm for decision-making. …”
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2089
Map Matching on Low Sampling Rate Trajectories Through Deep Inverse Reinforcement Learning and Multi Intention Modeling
Published 2024“…</li><li>`mm_sequence`: Contains codes and functions related to map matching sequence which includes functions for processing and matching sequences of GPS points to the underlying road network.…”
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2090
MOMA compared to MFA-derived estimates, carbon yield efficiencies and CBA co-factor profile comparison across unconstrained, manually curated and experimentally constrained solutio...
Published 2020“…MOMA ranges were estimated using the wild type solution as a reference and sequentially implementing the single-gene knockouts studied by Long et al. (2019) [<a href="http://www.ploscompbiol.org/article/info:doi/10.1371/journal.pcbi.1008125#pcbi.1008125.ref046" target="_blank">46</a>], with biomass formation as the objective function. MFA ranges were extracted from a pre-existing dataset (Long et al., 2019), using a Python algorithm to select the minimal and maximal flux ranges.…”
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2091
Code
Published 2025“…We implemented machine learning algorithms using the following R packages: rpart for Decision Trees, gbm for Gradient Boosting Machines (GBM), ranger for Random Forests, the glm function for Generalized Linear Models (GLM), and xgboost for Extreme Gradient Boosting (XGB). …”
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2092
Core data
Published 2025“…We implemented machine learning algorithms using the following R packages: rpart for Decision Trees, gbm for Gradient Boosting Machines (GBM), ranger for Random Forests, the glm function for Generalized Linear Models (GLM), and xgboost for Extreme Gradient Boosting (XGB). …”
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2093
Data_Sheet_1_Exploring changes in depression and radiology-related publications research focus: A bibliometrics and content analysis based on natural language processing.docx
Published 2022“…The unsupervised Leuven algorithm was used to build a network to identify relationships between research focus.…”
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2094
Mechanomics Code - JVT
Published 2025“…The functions were tested respectively in: MATLAB 2018a or youger, Python 3.9.4, R 4.0.3.…”
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2095
Table_5_MeiosisOnline: A Manually Curated Database for Tracking and Predicting Genes Associated With Meiosis.XLSX
Published 2021“…Annotation information was provided for both meiotic genes and predicted candidates, including basic information, function, protein–protein interaction (PPI), and expression data. …”
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2096
Image_4_MeiosisOnline: A Manually Curated Database for Tracking and Predicting Genes Associated With Meiosis.TIF
Published 2021“…Annotation information was provided for both meiotic genes and predicted candidates, including basic information, function, protein–protein interaction (PPI), and expression data. …”
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2097
Table_8_MeiosisOnline: A Manually Curated Database for Tracking and Predicting Genes Associated With Meiosis.XLSX
Published 2021“…Annotation information was provided for both meiotic genes and predicted candidates, including basic information, function, protein–protein interaction (PPI), and expression data. …”
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2098
Table_3_MeiosisOnline: A Manually Curated Database for Tracking and Predicting Genes Associated With Meiosis.XLSX
Published 2021“…Annotation information was provided for both meiotic genes and predicted candidates, including basic information, function, protein–protein interaction (PPI), and expression data. …”
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2099
Table_6_MeiosisOnline: A Manually Curated Database for Tracking and Predicting Genes Associated With Meiosis.XLSX
Published 2021“…Annotation information was provided for both meiotic genes and predicted candidates, including basic information, function, protein–protein interaction (PPI), and expression data. …”
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2100
Table_4_MeiosisOnline: A Manually Curated Database for Tracking and Predicting Genes Associated With Meiosis.XLSX
Published 2021“…Annotation information was provided for both meiotic genes and predicted candidates, including basic information, function, protein–protein interaction (PPI), and expression data. …”