Use Chemical Terms for calculations
Let's see how to calculate some basic properties of aspririn.
The applied Chemical Terms expressions are as follows:
These calculations return 180.16 and 1.24 as mass and logP of aspirin, respectively.
The Chemical Terms expressions can also be used to filter molecules for which the investigated properties can be calculated prior to filtering.
We list here two simple rules. The first one defines that the mass of the compounds should be less than 500, whereas the second one states that the logP should be not greater than 5.
Accordingly, mathematical symbols like greater than, less than can be applied conventionally in Chemical Terms.