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Navigation: Home
\ Graphic Apps
\ CAD \ Open3DQSAR
Open3DQSAR2.24 by Paolo Tosco |
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Software Description:
Open3DQSAR is an open-source tool aimed at pharmacophore exploration by high-throughput chemometric analysis of molecular interaction fields (MIFs). Open3DQSAR can generate steric potential, electron density and MM/QM electrostatic potential fields; furthermore, it can import GRIDKONT binary files produced by GRID and CoMFA/CoMSIA fields (exported from SYBYL with the aid of a small SPL script). ...
type: Open Source
Download Open3DQSARcategories: chemometric analysis, analyze MIF, pharmacophore exploration, MIF, analysis, chemometry Add to Download Basket Report virus or spyware |
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| Software Info | |
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Best Vista Download periodically updates pricing and software information of Open3DQSAR full version from the publisher,
but some information may be out-of-date. You should confirm all information. Software piracy is theft, using crack, warez passwords, patches, serial numbers, registration codes, key generator, keymaker or keygen for Open3DQSAR license key is illegal and prevent future development of Open3DQSAR. Download links are directly from our mirrors or publisher's website, Open3DQSAR torrent files or shared files from rapidshare, yousendit or megaupload are not allowed! |
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| Released: | June 20, 2013 |
| Filesize: | 1.01 MB |
| Platform: | Windows XP, Windows Vista, Windows 7 |
| Install | Instal And Uninstall |
| Add Your Review or Windows Vista Compatibility Report |
Open3DQSAR- Releases History |
| Software: | Open3DQSAR 2.24 |
| Date Released: | Jun 20, 2013 |
| Status: | New Release |
| Release Notes: | · A bug which caused abrupt program exit when PyMOL was closed while Open3DQSAR was still running was fixed · Linking against libminizip is now optional |
| Software: | Open3DQSAR 2.23 |
| Date Released: | Jan 25, 2013 |
| Status: | New Release |
| Release Notes: | · A bug in the import type=DEPENDENT keyword which caused an error message whenever attempting to import multiple dependent variables was fixed |
| Software: | Open3DQSAR 2.22 |
| Date Released: | Jan 4, 2013 |
| Status: | New Release |
| Release Notes: | · The new type=MOE_GRID parameter was added to the prepare keyword to allow preparing a shape vector for the computation of interaction potentials within MOE using the same grid box settings as defined in Open3DQSAR · The new type=MOE_GRID parameter was added to the import keyword to allow importing in Open3DQSAR the interaction potential grids computed within MOE · The WriteMOEGRID.svl SVL script has been added to the util folder · Minor bugfixes all over |
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... models using different training/test set combinations, superposition schemes, variable selection and data scrambling procedures, etc. High computational performance is attained ... for MIF generation, PLS model building and validation, variable selection. FEATURES: · Multi-threaded computation of ...
type: Open Source
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