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Navigation: Home
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\ CAD \ Multiwfn
Multiwfn3.7 by sobereva |
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Software Description:
Multiwfn is a user-friendly, powerful and flexible program that aims for 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but some information may be out-of-date.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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MOPlot 1.93 download by Sourceforge
... into heavy atoms), and atomic spin populations (for open shell systems), if the corresponding information is available ... shaded mode. Pages can be configured to hold multiple images of any kind that can be displayed ...
type: Freeware
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categories: molecular orbital plotting, compute geometric parameters, molecular orbitals, visualization, molecule, orbital |
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Jmol 14.31.53 download by Egon Willighagen
... of file types and output from quantum chemistry programs, and animation of multi-frame files and computed normal modes from quantum programs. FEATURES: · The JmolApplet is a ... component into other Java applications. · Translated into multiple languages: Catalan (ca), Chinese (both zh_CN and zh_TW) ...
type: Open Source
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categories: quantum chemistry, 3D viewer, 3D chemical information, chemistry, chemical |
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Ocapy 0.402 download by Didier Gosseau
... Python. Runs under Windows 2000, XP, Vista, Seven. Open source software. · Implement RPN (Reverse Polish Notation) ... of shift, control keys and the like... · Multiple (virtually unlimited) precision calculation. · Support experimental real ...
type: Open Source
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categories: science calculator, engineer calculator, math calculator, calculator, calculation, calculate |
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Multiwfn 3.7 download by sobereva
... is substantially optimized. Most parts are parallelized by OpenMP technology. For time-consuming tasks, the efficiency of Multiwfn exceeds analogous programs significantly. Meanwhile, the memory requirement is very low. ... three dimension, the operations between data generated from multiple files can be defined. · Promolecule and deformation ...
type: Open Source
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categories: wavefunction analysis, topology analysis, molecular structure, analysis, analize, wavefunction |
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pRPN 0.5.5 Beta download by Sébastien Millet
... Complex, Vectors, Matrices, Binaries, Lists, Expressions, Strings and Programs. Implements RPL, the HP programming language of HP-28 and HP-48 series. ...
type: Open Source
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categories: math calculator, mathematics calculator, math calculation, calculator, calculate, calculation |
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JDet 1.4.1 download by Thilo Muth
... calculation and visualization of function-related conservation patterns in multiple sequence alignments and structures. It contains the set ... The package includes two of our recently developed programs for extracting this kind of information from protein ...
type: Open Source
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categories: protein alignment, view protein sequence, align protein sequence, visualization, align, alignment |
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Ocapy Portable 0.502 download by Didier Gosseau
... Python. Runs under Windows 2000, XP, Vista, Seven. Open source software. · Implement RPN (Reverse Polish Notation) ... of shift, control keys and the like... · Multiple (virtually unlimited) precision calculation. · Support experimental real ...
type: Open Source
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categories: science calculator, engineer calculator, math calculator, calculator, calculation, calculate |
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