Topic: molecular-docking-scripts Goto Github
Some thing interesting about molecular-docking-scripts
Some thing interesting about molecular-docking-scripts
molecular-docking-scripts,In-house Python code to assist for BIOS competition
User: danielsoenarto
molecular-docking-scripts,Dok2any is a small Python package designed to convert dok files generated by LeDock molecular docking software, a non-standard chemical structure file format unique for LeDock, to various other chemical structure formats using Openbabel.
User: dulaanr97
Home Page: https://github.com/dulaanr97/dok2any
molecular-docking-scripts,This package facilitates molecular docking simulations aimed at analyzing interactions between a target biological system and a collection of potential drug molecules. By leveraging computational algorithms, it ranks these molecules based on docking scores and interaction energies, providing insights into their suitability as drug candidates.
User: kumaranu
molecular-docking-scripts,Reproducing IA^3 2021 paper: "Mapping Irregular Computations for Molecular Docking to the SX-Aurora TSUBASA Vector Engine"
User: l30nardosv
molecular-docking-scripts,Reproducing IA^3 2020 Paper: "Parallelizing Irregular Computations for Molecular Docking"
User: l30nardosv
molecular-docking-scripts,Reproducing paper: "Benchmarking the Performance of Irregular Computations in AutoDock-GPU Molecular Docking"
User: l30nardosv
molecular-docking-scripts,SerenaRosi's GitHub page
User: serenarosi
molecular-docking-scripts,Molecular docking scripts for virtual screening studies
User: suleymanselim
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