Oleg trott in the molecular graphics lab (now ccsb) at the scripps research institute. Autodock tools is a module within the mgl tools software package specifically for generating input (pdbqt files) for autodock or vina. Vina is an effervescent oasis in the soda desert
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Vina started with a vision, to make soda smart Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading The latest stable version of autodock vina can be downloaded from the github repository Older versions are available here.
| history of changes questions, problems or suggestions Columns= [total, inter, intra, torsions, intra best pose] autodock ff Ndarray randomize(max_steps=10000) randomize the input ligand conformation What is the difference between autodock vina and autodock tools
