Ascalaph Quantum 1.7.12 freeware

The Ascalaph Quantum package provides interfaces to ab initio quantum mechanical packages NWChem, CP2K and PC GAMESS / Firefly. Quantum calculations are performed using the PC GAMESS program. ...

Author Agile Molecule
Released 2014-01-12
Filesize 86.80 MB
Downloads 578
OS Windows XP, Windows Vista, Windows Vista x64, Windows 7, Windows 7 x64, Windows 8, Windows 8 x64, Windows 10, Windows 10 x64
Installation Instal And Uninstall
Keywords Energy Calculation, Geometry Optimization, Properties Calculation, Quantum, Mechanical, Energy
Users' rating
(7 rating)
Ascalaph QuantumCADWindows XP, Windows Vista, Windows Vista x64, Windows 7, Windows 7 x64, Windows 8, Windows 8 x64, Windows 10, Windows 10 x64
Ascalaph Quantum - molecular Freeware Download Notice

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

Ascalaph Quantum freeware - The Latest User Reviews
Ascalaph Quantum freeware - The Latest Versions History
1.7.12 Jun 17, 2011 New Release

Most popular CAD freeware downloads

MarvinSketch

23.16.0 freeware download

... structural information. FEATURES: Chemical structure drawing Molecular modeling Tune, combine and view Predictors and enumerators Structure and valence checker Working with abbreviated groups ...

OpenBabelGUI

2.4.1 freeware download

... to search, convert, analyze, or store data from molecular modeling, chemistry, biochemistry, or related areas Features: ... over 90 chemical file formats Filter and search molecular files using SMARTS and other methods Supports molecular ...

PyRx

0.8 freeware download

PyRx is a Virtual Screening software for Computational Drug Discovery that can be used to screen libraries of compounds against potential drug targets. PyRx enables Medicinal ...

GelAnalyzer

23.1.1 freeware download

... of evaluation from automatic lane detection to precise molecular weight calculations. Many tools help you to improve ... repair gel run distortions · Accurate quantity and molecular weight calculations with 4 different calibration curve types. ...

Gabedit

2.5.1 freeware download

... of calculation results including support for most major molecular file formats. The advanced "Molecule Builder" allows to ... and (partially) ADF calculation results, including the following Molecular orbitals. Surfaces from the electron density, electrostatic potential, ...

MOPlot

1.93 freeware download

... a handy visualization application specially designed for fast molecular orbitals plotting from the outputs of the Gaussian 03/98/94, Molcas, Gamess/US quantum chemical calculation packages. This Molecular Orbital Plotting Program will prove to be easy-to-use ...

CueMol

2.2.3.442 freeware download

... with the user-friendly interfaces. Currently supported files are molecular coordinates (PDB format), electron density (CCP4, CNS , and BRIX format), MSMS surface data, and GRASP ...

Open3DGRID

2.3 freeware download

... is an application designed for high-throughput generation of molecular interaction fields or MIFs. Open3DGRID can generate steric potential, electron density and MM / QM electrostatic ...

Open3DQSAR x64

2.24 freeware download

... at pharmacophore exploration by high-throughput chemometric analysis of molecular interaction fields (MIFs). Open3DQSAR can generate steric potential, ... automated assignment of atom types to the imported molecular structures · Comprehensive output, including SDF molecular databases, ...

Open3DALIGN for Linux

2.28 freeware download

Open3DALIGN is an open-source software aimed at unsupervised molecular alignment. Open3DALIGN is a command-line tool which is ... for each compound of the dataset a quenched molecular dynamics (QMD) conformational search is carried out to ...