docking solutions from autodock v4.2 (AUTODOCK GmbH)
90
Structured Review
AUTODOCK GmbH
docking solutions from autodock v4.2
Docking Solutions From Autodock V4.2, supplied by AUTODOCK GmbH, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/docking+solutions+autodock/autodock+vina/pm37639732-860-15-14
Average 90 stars, based on 1 article reviews
Docking Solutions From Autodock V4.2, supplied by AUTODOCK GmbH, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/docking+solutions+autodock/autodock+vina/pm37639732-860-15-14
Average 90 stars, based on 1 article reviews
docking solutions from autodock v4.2 - by Bioz Stars,
2026-09
90/100 stars
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other:Article Title: Calculation of Free Energy of Binding for Widely Specific Pyrimidine-Nucleoside Phosphorylase and Suspected Inhibitors Article Snippet: Searching for a specific inhibitor of pyrimidine nucleoside phosphorylase (PyNP) was a central objective of the work.. The search was carried out by modeling protein–ligand complexes via molecular docking and molecular dynamics (MD), which make it possible to calculate the protein–ligand binding energy ΔGbind.. The following compounds were selected as possible inhibitors: 2',3'-didehydro-3'-deoxythymidine (d4T), 1-(2-deoxy-2-fluoro-β-D-arabinofuranosyl)-5-ioduracil (fiauridine, FIAU), 1-(2-deoxy-2-fluoroβ-D-arabinofuranosyl)-5-uracil (FAU), and 2-pyrimidin-2-yl-1H-imidazole-4-carboxylic acid (PIA). |