Open Binding Pose Metadynamics: An Effective Approach for the Ranking of Protein–Ligand Binding Poses by 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. …”

DataSheet1_Multi_Scale_Tools: A Python Library to Exploit Multi-Scale Whole Slide Images.PDF by Niccolò Marini (11247936)

“…<p>Algorithms proposed in computational pathology can allow to automatically analyze digitized tissue samples of histopathological images to help diagnosing diseases. …”

BOFdat Step 3: Identifying species-specific metabolic end goals. by Jean-Christophe Lachance (6619307)

Contrast enhancement of digital images using dragonfly algorithm by Soumyajit Saha (19726163)

“…Comparisons with state-of-art methods ensure the superiority of the proposed algorithm. The Python implementation of the proposed approach is available in this <a href="https://github.com/somnath796/DA_contrast_enhancement" target="_blank">Github repository</a>.…”

Complementary cumulative distribution functions of in degree distribution and fitted power law, lognormal and truncated power law distributions. by Olga Valba (10531121)

S1 File - by Yuh-Chin T. Huang (17867207)

“…In this study, we developed a computerized algorithm using the python package (pdfplumber) and validated against clinicians’ interpretation. …”

S1 Dataset - by Yuh-Chin T. Huang (17867207)

“…In this study, we developed a computerized algorithm using the python package (pdfplumber) and validated against clinicians’ interpretation. …”

State Preparation in Quantum Algorithms for Fragment-Based Quantum Chemistry by Ruhee D’Cunha (8921372)

“…The localized active space–unitary coupled cluster (LAS–UCC) algorithm iteratively loads a fragment-based multireference wave function onto a quantum computer. …”

CARNOT: a Fragment-Based Direct Molecular Dynamics and Virtual–Reality Simulation Package for Reactive Systems by Xin Chen (14149)

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CARNOT: a Fragment-Based Direct Molecular Dynamics and Virtual–Reality Simulation Package for Reactive Systems by Xin Chen (14149)

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CARNOT: a Fragment-Based Direct Molecular Dynamics and Virtual–Reality Simulation Package for Reactive Systems by Xin Chen (14149)

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CARNOT: a Fragment-Based Direct Molecular Dynamics and Virtual–Reality Simulation Package for Reactive Systems by Xin Chen (14149)

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CARNOT: a Fragment-Based Direct Molecular Dynamics and Virtual–Reality Simulation Package for Reactive Systems by Xin Chen (14149)

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CARNOT: a Fragment-Based Direct Molecular Dynamics and Virtual–Reality Simulation Package for Reactive Systems by Xin Chen (14149)

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Code For Use in a Bookកូដសម្រាប់ប្រើប្រាស់ក្នុងសៀវភៅ by Sarun Horn (20899271)

Active Learning Configuration Interaction for Excited-State Calculations of Polycyclic Aromatic Hydrocarbons by WooSeok Jeong (3206778)

“…These ALCI wave functions are promising and affordable starting points for the subsequent second-order perturbation theory or pair-density functional theory calculations.…”

Pseudo live-stream of EEG data is processed through the flow chart: after channel selection, each epoch undergoes Kaiser windowing (length = 250), followed by re-referencing to the... by Gursimran Singh (575288)

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PyNoetic’s online mode in action. Data is streamed from an Emotiv EPOC headset. by Gursimran Singh (575288)

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Illustration of PyNoetic’s 2D and 3D simulation module with visual feedback. by Gursimran Singh (575288)

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PyNoetic’s unique pick-place configurable flowchart that offers a no-code option for non-programmers. by Gursimran Singh (575288)

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