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- created : 2014-07-18
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- IP address: 34.249.61.56
- Location: Dublin Ireland
- Latitude: 53.3338
- Longitude: -6.2488
- Timezone: Europe/Dublin
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We found Websites Listing below when search with specdis-software.jimdofree.com on Search Engine
Version 1.71 - SpecDis
Web Download Linux, GTK 2. SpecDis uses gnuplot to produce plots of publication quality, it is tested with versions up to 5.1. EPS spectra should be plottable with all 4.x version but for png plotting you need at least version 4.6. Manual_V171.pdf. Adobe Acrobat Document …
Specdis-software.jimdofree.comStart - SpecDis
Web SpecDis is a handy tool to process the results of quantum-chemical ECD/UV, ORD, or VCD/IR calculations. It supports diverse software packages like ORCA, Gaussian03, Gaussian09, Gaussian16, Turbomole (escf, ricc2 tested only up to version 6.7), …
Specdis-software.jimdofree.comContact - SpecDis
Web SpecDis - A tool to compare calculated and experimental (chir)optical spectra. When you send me a message, make sure that the email adress you gave me is valid. I already got several mails that I could not answer as the email adress was not valid or behind a too …
Specdis-software.jimdofree.comSitemap - SpecDis
Web SpecDis is a handy tool to process the results of quantum-chemical ECD/UV, ORD, or VCD/IR calculations. It supports diverse software packages like ORCA, Gaussian03, Gaussian09, Turbomole etc
Specdis-software.jimdofree.comSpecDis - GitHub: Where the world builds software
Web SpecDis is a handy tool to process the results of quantum-chemical ECD/UV, ORD, or VCD/IR calculations. It supports diverse software packages like ORCA, Gaussian03, Gaussian09, Turbomole (escf, ricc2), NWChem, ADF, DALTON, or Grimme´s sTDA …
Github.comSpecDis/README.md at master · TBruhn74/SpecDis · GitHub
Web SpecDis is a handy tool to process the results of quantum-chemical ECD/UV, ORD, or VCD/IR calculations. It supports diverse software packages like ORCA, Gaussian03, Gaussian09, Turbomole (escf, ricc2), NWChem, ADF, DALTON, or Grimme´s sTDA …
Github.comSpecDis: Quantifying the Comparison of ... - Wiley Online Library
Web SpecDis: Quantifying the Comparison of Calculated and Experimental Electronic Circular Dichroism Spectra. Torsten Bruhn, ... All equations mentioned in the article are implemented in our SpecDis software, which has been developed to rapidly compare calculated ECD …
Onlinelibrary.wiley.comSpecDis/LICENSE at master · TBruhn74/SpecDis · GitHub
Web SpecDis/LICENSE. Go to file. Cannot retrieve contributors at this time. 7 lines (5 sloc) 461 Bytes. Raw Blame. Permission to use, copy this software and its documentation for private use is hereby granted to non-profit organisations. This software is provided "as is" …
Github.comActions · TBruhn74/SpecDis · GitHub
Web SpecDis is a handy tool to process the results of quantum-chemical ECD/UV, ORD, or VCD/IR calculations. It supports diverse software packages like ORCA, Gaussian03, Gaussian09, Turbomole (escf, ricc2), NWChem, ADF, DALTON, or Grimme´s sTDA …
Github.comPackages · TBruhn74/SpecDis · GitHub
Web SpecDis is a handy tool to process the results of quantum-chemical ECD/UV, ORD, or VCD/IR calculations. It supports diverse software packages like ORCA, Gaussian03, Gaussian09, Turbomole (escf, ricc2), NWChem, ADF, DALTON, or Grimme´s sTDA …
Github.comtesliper: a theoretical spectroscopist’s little helper - ResearchGate
Web spectra (SpecDis, ComputeVO A, ChemCraft). Other packages lack important features, like comparison of conformers’ geometry (SpecDis, CDspecT ech, GaussView) or population-based
Researchgate.netFile Finder · GitHub
Web SpecDis is a handy tool to process the results of quantum-chemical ECD/UV, ORD, or VCD/IR calculations. It supports diverse software packages like ORCA, Gaussian03, Gaussian09, Turbomole (escf, ricc2), NWChem, ADF, DALTON, or Grimme´s sTDA …
Github.comWelcome to tesliper’s documentation! — tesliper 0.9.3 …
Web The software offers a Python API and a graphical user interface (GUI), allowing for your preferred style of interaction with the computer: visual or textual. It’s main goal is to minimize time and manual work needed to simulate optical spectrum of investigated compound. ...
Tesliper.readthedocs.ioJimdo
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Speed-software.jimdofree.comCreate Your Free Website - Free Web Hosting | Jimdo
Web How to make a free website: Create your Jimdo account. Click on “create a new website“. Customize your website in your browser—no external software required. Choose your design and personalize it to fit your style. You're all set! Your free website is …
Jimdo.comSPDIS Meaning | What Does SPDIS Stand For? - All Acronyms
Web What does SPDIS abbreviation stand for? List of 1 best SPDIS meaning form based on popularity. Most common SPDIS abbreviation full form updated in February 2023
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