Multiwfn

Version: 3.7 | Size: 15.90 MB | Filename: Multiwfn_3.7_bin_Win64.rar

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                                    Top Download Club is proud to feature Multiwfn, a powerful software developed by sobereva. Multiwfn is a versatile program for the analysis of molecular wave function and electron density. It provides a wide range of functions including signal processing, molecular structure analysis, orbital analysis, and more. This software is perfect for researchers and students in the field of computational chemistry, as it allows for the visualization and interpretation of complex computations with ease. With Multiwfn, users have access to advanced features, such as plot customization and integration of multiple functions, that make it stand out from its competitors. Its user-friendly interface and rich documentation make even complex tasks manageable, making it suitable for both beginners and experienced users alike. Multiwfn is a must-have tool for any serious researcher or student in the field of computational chemistry.
                                

Keywords:

topology analysis, versatile, molecular structure, user-friendly, computational chemistry, analysis, post-processing, Multiwfn, analize, sobereva, wavefunction analysis, wavefunction

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User Rating: 4.0 (69 votes)

Currently 4.00/5
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Licence:
Open Source

Price:
FREE

File size:
15.90 MB

Last update:
Aug 14, 2020

OS:
Windows Vista, Windows Vista x64, Windows 7, Windows 7 x64, Windows 8, Windows 8 x64, Windows 10, Windows 10 x64, Windows 11

Last version:
3.7

Downloads:
40

Developer
sobereva
http://multiwfn.codeplex.com/

SEARCH ALTERNATIVE TOP DOWNLOAD

topology mapping wavefunction analysis chemistry diagram topology molecular structure wavefunction analize disk versatile analysis chemistry chemistry diffraction postprocessing molecular analysis topology diagram chemistry tool 3d molecular structure topology analysis chemistry analysis multiwfn analize computational chemistry

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Version	Change log
Multiwfn 3.7 Aug 14, 2020
Multiwfn 3.6 May 21, 2019	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.