About MolPrime+
MolPrime+ is a chemical structure drawing tool based on the unique sketcher from the Mobile Molecular DataSheet (MMDS). Features: - draw chemical structures - send structure data via email - open structures from email or...
MolPrime+ is a chemical structure drawing tool based on the unique sketcher from the Mobile Molecular DataSheet (MMDS). Features: - draw chemical structures - send structure data via email - open structures from email or web - create graphical images or Microsoft Word documents with embedded structure graphics - calculate properties based on structures - search public databases (ChEBI, PubChem) by structure or name
Version History Upgraded to latest iOS version. 1.2.7 01/03/2019 Maintenance release. 1.2.6 02/05/2018 Upgraded to iOS 11. 1.2.5 11/13/2017 Maintenance release. 1.2.2 09/12/2015 Model calculation now includes prepackaged Bayesian models for predicting properties (probabilistic): water solubility, Lipinski probelikeness, KCNQ and hERG avoidance, activity vs. Chagas disease, Bubonic plague, Malaria and Tuberculosis. 1.2.1 02/03/2015 Property calculation has been redesigned: all structure-based properties are now calculated within the app itself, rather than calling out to a webservice. These are shown as a preview when opening the main menu buttons, as well as in a fullscreen mode. Properties include simple scalars such as molecular formula/weight, rotatable bonds, H-bonding donors/acceptors, and harder-to-calculate properties such as log P. Stereocentres (R/S and E/Z) are calculated and shown visually as a molecular overlay. Tautomers are calculated and shown as a collection, with affect atoms highlighted, and stereocentres ambiguated as appropriate. Atomic valence violations (e.g. tetravalent neutral nitrogen atoms) are shown with a visual overlay. Mass distributions are calculated and shown, with exact mass included. PAINS filters are determined, and shown as atomic overlays, for structures that are likely frequent hitters for drug screening programmes. 1.2 01/22/2015 New calculated property preview: the main menu context view now shows calculated properties in a mini side-scrolling view. Also, calculation of PAINS filters (for assay frequent hitters) is calculated within the app. Sketcher improvements and bugfixes. 1.1.10 01/12/2015 Improved the integrated sketcher tooltips. 1.1.9 11/12/2014 Bug fixes. 1.1.8 10/19/2014 Upgraded to iOS 8, and the new iPhone 6 form factors. 1.1.7 09/30/2014 Upgraded to iOS 7. Minor bugfixes. 1.1.6 03/13/2014 Bugfix: now saves content after pasting or searching. 1.1.5 10/25/2013 Updated for iOS 7. 1.1.4 10/02/2013 Interoperability menu enabled in the sketcher: can export content in various ways. Atom numbering capability added. Maintenance and miscellaneous improvements. 1.1.3 06/05/2013 Improvements to public database searching: intermediate results are shown while waiting; vendor information is now available; and the ChemSpider database joins PubChem and ChEBI. 1.1.2 04/26/2013 Main menu allows images to be copied onto the clipboard as bitmaps, which can be pasted into other apps, such as Keynote or Pages. 1.1.1 04/08/2013 Adds searching of public databases, integrated into the app interface: PubChem and ChEBI can be searched by name, structure, substructure and similarity. 1.1 01/24/2013 Updated for iPhone 5 form factor. 1.0.8 11/10/2012 The property calculator panel can now furnish a mass distribution, suitable for helping out with mass spectroscopy structure determination. It also calculates the accurate mass of the base peak. 1.0.7 08/02/2012 Maintenance release. 1.0.6 07/07/2012 Molecules can be shared on the web and tweeted. 1.0.5 06/05/2012 Maintenance release: performance improvements for retina-class devices. 1.0.4 04/27/2012 Property calculation can now use the remote webservice to obtain: - stereochemical annotations (R/S, Z/E), which are displayed in an overlay - an enumerated list of tautomers, which can be navigated by tapping on the outlined transform atoms 1.0.3 04/20/2012 Two major usability enhancements: (1) Additional tool banks on the left and right side of the sketcher provide simplified drawing tools that are more familiar to users of desktop chemical drawing software. (2) A tooltip system provides tips, live demonstrations and links to documentation. 1.0.2 04/12/2012 Property calculations now include TPSA (Topological Polar Surface Area). 1.0.1 03/20/2012
Previous Versions
Here you can find the changelog of MolPrime+ since it was posted on our website on 2016-09-27 22:42:48.
The latest version is 1.2.7 and it was updated on 2026-06-23 06:49:53. See below the changes in each version.
MolPrime+ version 1.2.7
Updated At: 2026-06-02
Changes: Version History Upgraded to latest iOS version. 1.2.7 01/03/2019 Maintenance release. 1.2.6 02/05/2018 Upgraded to iOS 11. 1.2.5 11/13/2017 Maintenance release. 1.2.2 09/12/2015 Model calculation now includes prepackaged Bayesian models for predicting properties (probabilistic): water solubility, Lipinski probelikeness, KCNQ and hERG avoidance, activity vs. Chagas disease, Bubonic plague, Malaria and Tuberculosis. 1.2.1 02/03/2015 Property calculation has been redesigned: all structure-based properties are now calculated within the app itself, rather than calling out to a webservice. These are shown as a preview when opening the main menu buttons, as well as in a fullscreen mode. Properties include simple scalars such as molecular formula/weight, rotatable bonds, H-bonding donors/acceptors, and harder-to-calculate properties such as log P.
Stereocentres (R/S and E/Z) are calculated and shown visually as a molecular overlay. Tautomers are calculated and shown as a collection, with affect atoms highlighted, and stereocentres ambiguated as appropriate. Atomic valence violations (e.g. tetravalent neutral nitrogen atoms) are shown with a visual overlay. Mass distributions are calculated and shown, with exact mass included. PAINS filters are determined, and shown as atomic overlays, for structures that are likely frequent hitters for drug screening programmes. 1.2 01/22/2015 New calculated property preview: the main menu context view now shows calculated properties in a mini side-scrolling view. Also, calculation of PAINS filters (for assay frequent hitters) is calculated within the app. Sketcher improvements and bugfixes. 1.1.10 01/12/2015 Improved the integrated sketcher tooltips. 1.1.9 11/12/2014 Bug fixes. 1.1.8 10/19/2014 Upgraded to iOS 8, and the new iPhone 6 form factors. 1.1.7 09/30/2014 Upgraded to iOS 7. Minor bugfixes. 1.1.6 03/13/2014 Bugfix: now saves content after pasting or searching. 1.1.5 10/25/2013 Updated for iOS 7. 1.1.4 10/02/2013 Interoperability menu enabled in the sketcher: can export content in various ways. Atom numbering capability added. Maintenance and miscellaneous improvements. 1.1.3 06/05/2013 Improvements to public database searching: intermediate results are shown while waiting; vendor information is now available; and the ChemSpider database joins PubChem and ChEBI. 1.1.2 04/26/2013 Main menu allows images to be copied onto the clipboard as bitmaps, which can be pasted into other apps, such as Keynote or Pages. 1.1.1 04/08/2013 Adds searching of public databases, integrated into the app interface: PubChem and ChEBI can be searched by name, structure, substructure and similarity. 1.1 01/24/2013 Updated for iPhone 5 form factor. 1.0.8 11/10/2012 The property calculator panel can now furnish a mass distribution, suitable for helping out with mass spectroscopy structure determination. It also calculates the accurate mass of the base peak. 1.0.7 08/02/2012 Maintenance release. 1.0.6 07/07/2012 Molecules can be shared on the web and tweeted. 1.0.5 06/05/2012 Maintenance release: performance improvements for retina-class devices. 1.0.4 04/27/2012 Property calculation can now use the remote webservice to obtain:
- stereochemical annotations (R/S, Z/E), which are displayed in an overlay
- an enumerated list of tautomers, which can be navigated by tapping on the outlined transform atoms 1.0.3 04/20/2012 Two major usability enhancements:
(1) Additional tool banks on the left and right side of the sketcher provide simplified drawing tools that are more familiar to users of desktop chemical drawing software.
(2) A tooltip system provides tips, live demonstrations and links to documentation. 1.0.2 04/12/2012 Property calculations now include TPSA (Topological Polar Surface Area). 1.0.1 03/20/2012
MolPrime+ version 1.2.7
Updated At: 2020-01-04
Changes: 3 janv. 2019 Version 1.2.7
Upgraded to latest iOS version.
MolPrime+ version 1.2.7
Updated At: 2019-01-03
Changes: Jan 3, 2019 Version 1.2.7
Upgraded to latest iOS version.
MolPrime+ version 1.2.7
Updated At: 2019-01-03
Changes: Upgraded to latest iOS version.
MolPrime+ version 1.2.2
Updated At: 2012-01-31
MolPrime+ version 1.2.7
Updated At: 1970-01-01
Changes: 2019년 1월 3일 Version 1.2.7
Upgraded to latest iOS version.
MolPrime+ version 1.2.7
Updated At: 1970-01-01
Changes: 3 Thg 01, 2019 Version 1.2.7
Upgraded to latest iOS version.
MolPrime+ version 1.2.7
Updated At: 1970-01-01
Changes: 3 de Jan de 2019 Version 1.2.7
Upgraded to latest iOS version.
MolPrime+ version 1.2.7
Updated At: 1970-01-01
Changes: 2019年1月3日 Version 1.2.7
Upgraded to latest iOS version.
Disclaimer
Official App Store Link
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