Revisiting the “satisfaction of spatial restraints” approach of MODELLER for protein homology modeling حسب Giacomo Janson (8138517)

"…This program implements the “modeling by satisfaction of spatial restraints” strategy and its core algorithm has not been altered significantly since the early 1990s. …"

Genetic algorithms can be applied to higher-dimensional design problems. حسب Lu Hong (399882)

Example of use of the slightly off-axis strategies. حسب Raul Castañeda (13932971)

Example of the fully-compensated phase reconstruction package for off-axis DHM holograms recorded in telecentric configuration. حسب Raul Castañeda (13932971)

The algorithm underlying neoVM. حسب Tanmoy Sarkar (627505)

Comparison of edge detector and CHT in detecting droplets. حسب Manibarathi Vaithiyanathan (6655274)

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

ClaritySpectra: Raman spectra analysis tool حسب Aaron Celestian (9395696)

"…</li><li>Pre-compiled database from RRUFF and SLOPP that includes Hey Index of classification, chemistry, locality, paragenesis, mineral evolution stage, etc.</li></ul><h3>PEAK FITTING </h3><ul><li>Automated background subtraction using asymmetric least squares fitting</li><li>A new suggested background feature that lets you preview the background that you like best</li><li>Interactive background fitting lets you further tune the background to perfection</li><li>Four choice of peaks: Gaussian, Lorentzian, Pseudo-Voigt, and the new Asymmetric Voigt functions</li><li>Overlapping view of how well the peaks fit with quality metrics</li><li>No need to define regions, the algorithm is smart enough to what a peak looks like.…"

Python code, input data, and outputs of Fourier analysis and Dynamic Time Warping from McGlasson et al. حسب Riley McGlasson (13876874)

"…</p> <h4><strong>Python Function Files:</strong></h4> <p>radarfuncs.py: Holds three functions used for FFT and DTW analysis.…"

A Solvent Selection Framework for Porous Organic Polymers حسب Xue Fang (648169)

"…In this work, we present a solvent selection toolkit for functional porous organic polymers. We have developed the <i>MLoc</i> algorithm for the fast determination of Hansen solubility parameters (HSPs) for novel materials. …"

Drug Release Nanoparticle System Design: Data Set Compilation and Machine Learning Modeling حسب Shan He (121220)

الموضوعات:

CMA-ES performance during the iterations of the normalization method according to the objective function with <i>t</i> = 0. حسب Sofya Feldman (19590649)

Table_1_NeuroRA: A Python Toolbox of Representational Analysis From Multi-Modal Neural Data.pdf حسب Zitong Lu (9913770)

Presentation_2_NeuroRA: A Python Toolbox of Representational Analysis From Multi-Modal Neural Data.pdf حسب Zitong Lu (9913770)

Table_2_NeuroRA: A Python Toolbox of Representational Analysis From Multi-Modal Neural Data.pdf حسب Zitong Lu (9913770)

Image_1_NeuroRA: A Python Toolbox of Representational Analysis From Multi-Modal Neural Data.pdf حسب Zitong Lu (9913770)

Presentation_3_NeuroRA: A Python Toolbox of Representational Analysis From Multi-Modal Neural Data.pdf حسب Zitong Lu (9913770)

Presentation_1_NeuroRA: A Python Toolbox of Representational Analysis From Multi-Modal Neural Data.pdf حسب Zitong Lu (9913770)

Table_3_NeuroRA: A Python Toolbox of Representational Analysis From Multi-Modal Neural Data.pdf حسب Zitong Lu (9913770)

Open Binding Pose Metadynamics: An Effective Approach for the Ranking of Protein–Ligand Binding Poses حسب Dominykas Lukauskis (14143149)

"…OpenBPMD is powered by the OpenMM simulation engine and uses a revised scoring function. The algorithm was validated by testing it on a wide range of targets and showing that it matches or exceeds the performance of the original BPMD. …"