Es könnte so schön sein...
...aber in IOS 12 auf Grund von Abstürzen nicht benutzbar.
Description
WebMO allows users to build and view molecules in 3-D, visualize orbitals and symmetry elements, lookup chemical information and properties from external databases, and access state-of-the-art computational chemistry programs.
WebMO is recommended for students and faculty in high school, college, and graduate school who desire mobile access to molecular structures, information, and calculations.
WebMO capabilities include:
- Build molecules by drawing atoms and bonds in a 3-D molecular editor, or by speaking the name (e.g., “aspirin”)
- Optimize structures using VSEPR theory or molecular mechanics
- View Huckel molecular orbitals, electron density, and electrostatic potential
- View molecular vibrations
- View point group and symmetry elements of molecules
- Lookup basic molecular information, including IUPAC and common names, stoichiometry, molar mass
- Lookup chemical data from PubChem and ChemSpider
- Lookup experimental and predicted molecular properties from external databases (NIST, Sigma-Aldrich)
- Lookup IR, UV-VIS, NMR, and mass spectra from external databases (NIST, SDBS)
- Capture high-resolution molecular images
- Save and recall molecular structures locally
- Export and import structures via email
WebMO is also a front-end to WebMO servers (version 14 and higher):
- Supports Gaussian, GAMESS, Molpro, MOPAC, NWChem, ORCA, PQS, PSI, Quantum Espresso, VASP, Q-Chem, and Tinker computational chemistry programs
- Submit, monitor, and view calculations
- View formatted tabular data extracted from output files, as well as raw output
- Visualize geometry, partial charges, dipole moment, normal vibrational modes, molecular orbitals, and NMR/IR/UV-VIS spectra
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WebMO is recommended for students and faculty in high school, college, and graduate school who desire mobile access to molecular structures, information, and calculations.
WebMO capabilities include:
- Build molecules by drawing atoms and bonds in a 3-D molecular editor, or by speaking the name (e.g., “aspirin”)
- Optimize structures using VSEPR theory or molecular mechanics
- View Huckel molecular orbitals, electron density, and electrostatic potential
- View molecular vibrations
- View point group and symmetry elements of molecules
- Lookup basic molecular information, including IUPAC and common names, stoichiometry, molar mass
- Lookup chemical data from PubChem and ChemSpider
- Lookup experimental and predicted molecular properties from external databases (NIST, Sigma-Aldrich)
- Lookup IR, UV-VIS, NMR, and mass spectra from external databases (NIST, SDBS)
- Capture high-resolution molecular images
- Save and recall molecular structures locally
- Export and import structures via email
WebMO is also a front-end to WebMO servers (version 14 and higher):
- Supports Gaussian, GAMESS, Molpro, MOPAC, NWChem, ORCA, PQS, PSI, Quantum Espresso, VASP, Q-Chem, and Tinker computational chemistry programs
- Submit, monitor, and view calculations
- View formatted tabular data extracted from output files, as well as raw output
- Visualize geometry, partial charges, dipole moment, normal vibrational modes, molecular orbitals, and NMR/IR/UV-VIS spectra
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1 ratings in Germany
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Ratings History
WebMO Molecule Editor Installs
Last 30 daysWebMO Molecule Editor Revenue
Last 30 daysWebMO Molecule Editor Reviews
Etwas problematisch
Im leeren Dokument können durch tap/drag nur schwer Atome/Bindungen erzeugt werden. Man muss mehrfach mit verschiedenem Andruck/Geschwindigkeit tippen, bis ein Atom erscheint. Einige Limitierungen erschweren die Nutzung: - unterstützt kein .mol2 Format, bitte zufügen, da sehr populär! - wenn ich Alkylketten kappe um Rechnungen zu beschleunigen versagt das automatische H-Substituenten zufügen. - das Setzen von Hybridisierung und Ladung auf Atomen ist weder intuitiv noch chemisch immer plausibel - es können wohl keine Abstände, Winkel gemessen werden, trotz Lineal Symbol Insgesamt noch durchwachsen, aber echtes Modelling auf iOS hat Potential!
Awesome!
I love it! Awesome App! :)
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App Info
- Category
- Education
- Publisher
- WebMO
- Languages
- Arabic, Catalan, Czech, Danish, Dutch, English, Finnish, French, German, Greek (modern), Hebrew (modern), Hungarian, Indonesian, Italian, Japanese, Korean, Malay, Norwegian Bokmål, Polish, Portuguese, Romanian, Russian, Chinese, Slovak, Spanish, Swedish, Thai, Chinese, Turkish, Vietnamese
- Recent version
- 2.2.2 (1 week ago )
- Released on
- Feb 7, 2014 (10 years ago )
- Also available in
- United States, China, Japan, Brazil, Mexico, Canada, Italy, United Kingdom, India, Australia, Switzerland, Russia, Colombia, Taiwan, Netherlands, South Korea, Vietnam, Indonesia, Hong Kong, Greece, Argentina, Spain, Egypt, Austria, Chile, Germany, Czechia, Philippines, Belarus, Pakistan, Poland, Portugal, Romania, Belgium, Saudi Arabia, Sweden, Singapore, Thailand, Turkey, Azerbaijan, Ukraine, United Arab Emirates, South Africa, Kuwait, France, Ecuador, Hungary, Algeria, Ireland, Israel, Dominican Republic, Denmark, Peru, Kazakhstan, Lebanon, Malaysia, Nigeria, Finland, Norway, New Zealand
- Last updated
- 3 weeks ago