Open3DQSAR for Mac OS X 2.24 freeware

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). ...

Author Paolo Tosco
Released 2013-06-20
Filesize 1.10 MB
Downloads 540
OS Mac OS X
Installation Instal And Uninstall
Keywords chemometric analysis, analyze MIF, pharmacophore exploration, MIF, analysis, chemometry
Users' rating
(8 rating)
Open3DQSAR for Mac OS XCADMac OS X
Open3DQSAR for Mac OS X - packages Freeware Download Notice

Open3DQSAR for Mac OS X Free Download - we do not host any Open3DQSAR for Mac OS X torrent files or links of Open3DQSAR for Mac OS X on rapidshare.com, depositfiles.com, megaupload.com etc. All Open3DQSAR for Mac OS X download links are direct Open3DQSAR for Mac OS X download from publisher site or their selected mirrors.

Open3DQSAR for Mac OS X freeware - The Latest User Reviews
Open3DQSAR for Mac OS X freeware - The Latest Versions History
2.24 Jun 20, 2013 New Release · A bug which caused abrupt program exit when PyMOL was closed while Open3DQSAR was still running was fixed
· Linking against libminizip is now optional
2.23 Jan 25, 2013 New Release · A bug in the import type=DEPENDENT keyword which caused an error message whenever attempting to import multiple dependent variables was fixed
2.22 Jan 4, 2013 New Release · 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

Most popular CAD freeware downloads

Open3DQSAR x64

2.24 freeware download

... gnuplot · User-friendly interface to all major QM packages (e.g. GAUSSIAN, FIREFLY, GAMESS-US, MOLDEN) allows calculation of QM electron density and electrostatic potential 3D maps ...

DipTrace Free

4.3.0.0 freeware download

... layouts, and libraries with other EDA and CAD packages. Output formats: DXF, Gerber, ODB++, Gerber X2, IPC-D-356A, N/C Drill, and G-code. Standard libraries contain over ...

MOPlot

1.93 freeware download

... the Gaussian 03/98/94, Molcas, Gamess/US quantum chemical calculation packages. This Molecular Orbital Plotting Program will prove to be easy-to-use and very efficient. MOPlot can ...

Open3DQSAR for Mac OS X

2.24 freeware download

... gnuplot · User-friendly interface to all major QM packages (e.g. GAUSSIAN, FIREFLY, GAMESS-US, MOLDEN) allows calculation of QM electron density and electrostatic potential 3D maps ...

Engauge Digitizer for Windows

12.0 freeware download

... and XPM * Export support for common software packages such as Microsoft Excel, OpenOffice CALC, gnuplot, gnumeric, MATLAB and Mathematica * Engauge is available for ...

5 freeware award

SCaVis

2.3 freeware download

... and students. The program incorporates many open-source software packages into a coherent interface using the concept of ... high-level interpreted language can be used. Comprehensive statistical packages. More than 10 thousand JAVA classes and methods ...

5 freeware award

Gabedit

2.5.1 freeware download

... is a graphical user interface to computational chemistry packages like Gamess-US, Gaussian, Molcas, Molpro, MPQC, OpenMopac, Orca, PCGamess and Q-Chem It can display a ...

Gabedit for Linux

2.5.1 freeware download

... is a graphical user interface to computational chemistry packages like Gamess-US, Gaussian, Molcas, Molpro, MPQC, OpenMopac, Orca, PCGamess and Q-Chem It can display a ...

Engauge Digitizer for Linux

12.0 freeware download

... and XPM * Export support for common software packages such as Microsoft Excel, OpenOffice CALC, gnuplot, gnumeric, MATLAB and Mathematica * Engauge is available for ...

SDMetrics

2.5 freeware download

... import in office applications, spreadsheet software and statistical packages. Interactive GUI: · With the easy-to-use SDMetrics graphical user interface, you can interactively explore measurement ...