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Navigation: Home
\ Graphic Apps
\ CAD \ Multiwfn
Multiwfn3.7 by sobereva |
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Software Description:
... general wavefunction analysis. Multiwfn accepts several kinds of files as wavefunction input: .wfn/.wfx (Conventional / Extended PROAIM wavefunction file), .31~.40(NBO plot file), .fch (Gaussian formatted check file). ...
type: Open Source
Download Multiwfncategories: wavefunction analysis, topology analysis, molecular structure, analysis, analize, wavefunction 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 Multiwfn 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but some information may be out-of-date.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 Multiwfn license key is illegal and prevent future development of Multiwfn. Download links are directly from our mirrors or publisher's website, Multiwfn torrent files or shared files from rapidshare, yousendit or megaupload are not allowed! |
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| Released: | August 14, 2020 |
| Filesize: | 15.90 MB |
| Platform: | Windows Vista, Windows Vista x64, Windows 7, Windows 7 x64, Windows 8, Windows 8 x64, Windows 10, Windows 10 x64, Windows 11 |
| Install | Instal And Uninstall |
| Add Your Review or Windows Vista Compatibility Report |
Multiwfn- Releases History |
| Software: | Multiwfn 3.7 |
| Date Released: | Aug 14, 2020 |
| Status: | New Release |
| Software: | Multiwfn 3.6 |
| Date Released: | May 21, 2019 |
| Status: | New Release |
| Release Notes: | A very powerful and easy-to-use RESP module is added into main function 7 (Population analysis). It can calculate the well-known ElectroStatic Potential (RESP) charge proposed in J. Phys. Chem., 97, 10269 (1993), and can also calculate ESP fitting charges under various customized conditions such as atomic equivalence constraint and fragment charge constraint. Multiple conformation is fully supported. See Section 3.9.16 for detailed introduction and Section 4.7.7 for examples. This module should be able to bring a revolution in the field of RESP charge derivation. Energy decomposition analysis based on UFF/AMBER/GAFF molecular forcefield is supported as subfunction 1 of main function 21. See corresponding introduction in Section 3.24.1 and examples in Section 4.21.1 of the manual. |
| Software: | Multiwfn 2.4 |
| Date Released: | May 23, 2012 |
| Status: | New Release |
| Release Notes: | · Fixed a bug introduced by Version 2.2.1 (that is Multiwfn crashes during reading the .fch files produced by unrestricted calculation with cartesian basis functions) · Fixed a bug in the interface for selecting the interbasin surfaces to be generated · A serious bug in reading the .fch files produced by unrestricted calculation with spherical basis functions is solved · Merz-Kollmann charge is supported in population module · Option 10 is added to topology analysis module, this is a small tool used to calculate Shannon aromaticity index |
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xFunc 4.1.0 download by sys27
... alike. Features: Calculating expressions (supported functions and operations); Supporting measures of angles; Derivative and simplifying expressions; Plotting graphs; Truth tables; Supported Framework: .NET Standard 2.1+; ...
type: Freeware
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categories: mathematics calculator, math expression calculator, build equation, mathematics, equation, logarithm |
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jHepWork 3.9 download by Dr. Sergei Chekanov
... libraries include numerical and analytical calculations, linear algebra operations, equation solving algorithms. Many libraries are based on ... AIDA data formats. Finally, it uses several platform-neutral file formats, including the compressed Google's Protocol Buffers format. ...
type: Freeware
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categories: data-analysis framework, data manipulation, data plotting, analyze, analysis, analyzer |
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SDMetrics 2.5 download by Jürgen Wüst
... model, subsystem, package level down to classes and operations. Design rule checking: · Design rules and ... SDMetrics with reverse engineering tools that produce XMI files from C++, Java, Delphi, or Smalltalk source code, ...
type: Freeware
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categories: analyze structural property, design metrics, establish benchmark, analyzer, analyze, measurement |
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SCaVis 2.3 download by Dr. Sergei Chekanov
... libraries include numerical and analytical calculations, linear algebra operations, equation solving algorithms. Many libraries are based on ... AIDA data formats. Finally, it uses several platform-neutral file formats, including the compressed Google's Protocol Buffers format. ...
type: Freeware
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categories: data-analysis framework, data manipulation, data plotting, analyze, analysis, analyzer |
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Simstat 2.6 download by Kovach Computing Services
... spreadsheet formats as well as ASCII and SPSS files. Data Management The data window is ... has the following features: - Reads standard DBF files up to 1024 variables (or fields). Can import ...
type: Demo ($695.00)
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categories: statistical analyses, analyze data, data analyzer, statistical, analyses, analyzer |
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Jmol 14.31.53 download by Egon Willighagen
... Jmol's features include reading a variety of file types and output from quantum chemistry programs, and animation of multi-frame files and computed normal modes from quantum programs. ... requirements · Support for unit cell and symmetry operations · Schematic shapes for secondary structures in biomolecules ...
type: Open Source
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categories: quantum chemistry, 3D viewer, 3D chemical information, chemistry, chemical |
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Digimizer 6.4.0 download by MedCalc Software
... characteristics. Pictures may be X-rays, micrographs, etc. Supported file formats are JPG, GIF, TIFF, BMP, PNG, WMF, EMF and DICOM files. Images can be rotated, flipped or straightened. ... filters can be applied. FEATURES: Image file operations Open, save and print image files ...
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Multiwfn 3.7 download by sobereva
... scope, data can be exported to Gaussian-type grid file (.cub) and can be viewed in terms of ... calculation in one, two and three dimension, the operations between data generated from multiple files can be ...
type: Open Source
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categories: wavefunction analysis, topology analysis, molecular structure, analysis, analize, wavefunction |
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ZWCAD 2020 download by ZWCAD Design Co., Ltd
... ZWCAD 2019 may tell: most commonly-used commands and operations: 150% faster on average; opening drawings: 32.4% faster; ... a table, or export them to an external file in .csv / .xls format. If you need ...
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Engauge Digitizer for Windows 12.0 download by Mark Mitchell
... This open source, digitizing software converts an image file showing a graph or map, into numbers. The image file can come from a scanner, digital camera or ... spreadsheet. The process starts with an image file containing a graph or map. The final result ...
type: Open Source
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categories: digitize image, image to number, process image, digitize, convert, digitizer |
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