Available now! The Molecule World User Guide!
The Molecule World User Guide covers both iPad and iPhone versions of Molecule World and describes how to:
- Find and display chemical and molecular structures
- Use different drawing and coloring styles to learn about molecules
- Display different molecules in different ways
Problems downloading from PDB?
New versions of both Molecule World for the iPhone and the Molecule World iPad apps that correct this problem are now available in the App store.
Explore biology and chemistry with Molecule World
What are some interesting molecules to explore?
How do I change the drawing or rendering styles?
How do I find out what the colors mean?
How can I look at molecules that aren't packaged in the application?
What kinds of molecules can I view?
Can I download and view molecules from the NCBI? or the PDB? PubChem?
Both Molecule World and the Molecule World DNA Binding Lab come with several molecular structures for you to explore. The structures in Molecule World represent proteins and chemicals that are commonly discussed in high school and college biology, such as hemoglobin, human insulin,cytochrome C oxidase, glucose, caffeine, and more. Learn how to get new structures in the Molecule World User Guide and check out examples on Facebook.
Other fun molecules to explore are described in our blog and on our community pages:
How do I change the drawing or rendering styles?
- Touch the molecule icon.
- Touch the drawing style.
- Touch the coloring style.
- Then, touch the screen somewhere outside of the menu to apply the new styles to your structure.
How do I find out what the colors mean?
Touch the palette icon to see a color key. If the coloring style is element, the colors will be shown for each element in the structure.
If the coloring style is either charge or hydrophobicity, a color key will be shown to indicate which colors correspond to the different states. For the charge coloring style, you will see colors for an amino acid that is either neutral, positive, negatively charged when in an aqueous solution on its own.
For hydrophobicity, you will see amino acids colored according to the Wimley–White whole residue hydrophobicity scale.
How can I look at molecules that aren't packaged in the application?
You can search one three databases. These are the NCBI Structure database (also called the Molecular Modeling Database or MMDB), the PubChem Compound database at the NCBI, and the PDB database. Download the Molecule World User Guide for detailed examples.
1. Touch the "My Molecules" button if your iPad is in portrait mode or touch the + if you're using landscape mode.
2. Type the name of structure you wish to find.
3. Select a database.
4. Click Enter/ Return
5. You will see a list of structures. Touch the arrowhead on the right side of the structure row to see more information. Touch the name of the structure to download it and open it in Molecule World.
What kinds of molecules can I view?
You can view molecules whose structures have been elucidated by experimentation and hypothetical molecules that only exist as pdb text files.
Sometimes the structures can vary. NCBI frequently has different versions of structures that show a default biological unit, a version with all biological units, and a version that shows the asymmetric unit. These three versions can look different from each other. Molecule World finds and shows the asymmetric unit by default. If you want to see a different version, you can often find and download those versions from the NCBI.
Can I download and view molecules from the NCBI? or the PDB? or PubChem? or other web sites?
Yes! All of the above.
For large molecules:
1. In Safari, go to the NCBI https://www.ncbi.nlm.nih.gov/ and search the structure database.
2. Pick the structure you want to see and the version you want to see.
3. Touch the View structure button.
The structure will download and a window like this will appear:
4. Touch "Open in "Molecule ..." to open the structure in Molecule World.
Sometimes, there are challenges with NCBI structures. If the structure fails to open, reopen Molecule World and touch the name of the structure at the bottom of the list.
For chemical structures from PubChem Compound:
1. Go to the NCBI and find your structure.
2. Touch the SDF block on the right to view your options for downloading the structure.
Some structures only have a 2D form. Some structures have both a 3D form and a 2D (flat) form.
3. Pick the form you want to see (2D or 3D) and touch the "Save" version to download it.
A page will appear where you can choose an application to open the structure.
4. Choose "Open in Molecule World" and you'll see the chemical structure in the Molecule World app.
