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Open3DQSAR x64
Open3DQSAR x64 2.24   
... interaction fields (MIFs). Open3DQSAR can generate steric potential, electron density and MM/QM electrostatic potential fields; furthermore, it ... GAUSSIAN, FIREFLY, GAMESS-US, MOLDEN) allows calculation of QM electron density and electrostatic potential 3D maps from within ...
Open Source
tags: x64 chemometric analysis, x64 analyze MIF, x64 pharmacophore exploration, x64 MIF, x64 analysis, chemometry x64, x64

SingleCrystal
SingleCrystal 5.0.0   
... fun! SingleCrystal can simulate X-ray, neutron and electron diffraction patterns from single crystals, as well as ... diffraction techniques such as Laue, Precession & transmission electron diffraction are simulated, with real-time structure/diffraction rotation and ...
Demo | $449.00
tags: Chemistry Diffraction, Chemistry Analysis, Molecule Simulation, Diffraction, Electron, Neutron

Open3DGRID x64
Open3DGRID x64 2.3   
... or MIFs. Open3DGRID x64 can generate steric potential, electron density and MM / QM electrostatic potential fields; furthermore, it can import GRIDKONT binary files produced by GRID and CoMFA / ...
Open Source
tags: x64 molecular interaction, x64 interaction field, x64 generate MIF, x64 molecule, x64 interaction, x64 field
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