chemicals | Chemical database of Chemical Engineering Design Library | Dataset library
kandi X-RAY | chemicals Summary
kandi X-RAY | chemicals Summary
chemicals: Chemical database of Chemical Engineering Design Library (ChEDL)
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Top functions reviewed by kandi - BETA
- Perform flash inner loop
- Calculate RACS solution for LSN
- Generate Rachford Rachford Rachford Riemann
- R Computes Li - Meier equation
- Calculates the Leibantoni equation
- The inner loop
- R Calculates erfprime - fprime - fprime - f - f - f - f - f - f - e - f - e - f - e - e - f - e - e - f - f - e - e - e - f - e
- Compute the rachford polynomials
- R Compute the composition of a chemical potential
- Returns the Tc
- Return the Tm constant for the specified CAS
- Returns the Tb parameter for the given CASRN
- Retrieve the RI and RIT data for a CASRN
- Retrieve chemical data for a given ID
- Get common_chemistry data from CASR
- Get data from a CAS file
- R Calculates the gravitational power term for a period of time t
- R Calculates the standard deviation of a functional over time t
- Returns the STEL for a given exposure
- Performs a CAS from a given chemical ID
- Return the TWA for a given CASNR
- Return the MW for the given amino acid ID
- Return the ceiling of the soil exposure
- Generate a line for a given CAS index
- Return the Tc value for the C
- Writes psi4Input to file
- Convert a mixed pressure to Vm
chemicals Key Features
chemicals Examples and Code Snippets
Community Discussions
Trending Discussions on chemicals
QUESTION
I have attempted adapting from some other solutions for slightly different situations. I am not being able to sort this out.
I would like to build a mirrored barplot comparing chemicals with controls, but with results grouped by chemical concentrations, and (if possible) both positive axes.
I provide data below, and an example of I would like it to generally look like.
...ANSWER
Answered 2022-Apr-16 at 02:58Like r2evans stated, the only way to do this is to use negative values in your data, and then manually use abs()
when labelling. More specifically, it would look something like this:
QUESTION
ANSWER
Answered 2022-Apr-08 at 07:22Process your data convert all values into % Ex: For Agriculture you have 120, 30, 30, total will be 180. Now, change values to % by dividing 120/180, 30/180, 30/180. Hence agriculture will be 100% when you sum it's targets
Repeat for all the groups you have, so your source should be equal to 100% when sum up, so heights of your source (left nodes) will be equal
QUESTION
I need find the bad data presented in imported text file. Bad data is the element that is not in this list:
...ANSWER
Answered 2022-Apr-05 at 04:32You have a more complex comparison than you are doing. You have two primary conditions:
- Is
taxPayers.salesstaff(i)
empty? (if so, you are done); or - Does each of the
taxPayers.salesstaff(i)
components, e.g.staff1:staff2:...
appear in thesalesStaff[]
array?
It is this second condition that is a many-to-many relationship that has many subconditions. In order to make this determination, you must separate the taxPayers.salesstaff(i)
entry on ':'
(much like you did input from your data file on ','
). Then you must loop over each entry and compare the entry against each in the salesStaff[]
array. If ONE of the entries in taxPayers.salesstaff(i)
does not match ANY of the entries in the salesStaff[]
array. then you have a bad entry.
You can use a couple of bool
flags to help you work through the checks. One way to do that is:
QUESTION
Source: text file stores list of account info. e.g:
...ANSWER
Answered 2022-Mar-28 at 07:52Parsing CSV file is an old topic. You will find at least 100 answers with code examples here on stackoverflow. Very often you will find a solution with the function std::getline
. Please read the documentation here. It can read characters from a std::ifstream
until or up to a delimiter (a comma ,
in our case), then store the result, without the comma, in a string and discard the comma from the stream. So, throwing that away. The characters will be stored in a std::string
. If numbers or other types are needed, we need to convert the string to the other type, using the appropriate function.
Example: We have a string consisting of characters ‘1’, ‘2’ and ‘3’, so, “123”. The quotes indicate the string type. If we want to convert this string into an integer, we can use for example the function std::stoi
.
In your case, you have 2 double values. So, we would split the input of the file into strings and then convert the 2 strings with the double values in it, using the function std::stod
.
What you need to know additionally is, that often a 2 step approach is used. This is done to prevent potential problems arising from extracting all the string parts from one csv line. So,
- we first read a complete line,
- then put that line into a
std::istringstream
, and finally - read input and split the CSV from there.
Then, the rest is simple. Just use std::getline
to al the data that you need.
Last but not least, to read the file, we will simply open it, read line by line, create an “EmployeeAccount” and push that into a std::vector
At the end we do some debug output.
Please see below one of may potential implementation proposals:
QUESTION
I try to analyze all the variables in my data set to see which set of variables is describing my dependent variable StockPrice the best. The following code is the one I use to do so:
...ANSWER
Answered 2022-Jan-04 at 19:35BLUF or the more trendy TL;DR
I think that the function ols_step_best_subset
has limitations. However, there are other ways to get what you are looking for.
The long version:
Okay, I worked with the data you provided, but I did not run into any of the issues you ran into. I thought it may have been due to how few rows of data you had provided. (You provided a lot of information! There just isn't a lot for the model to work with.)
Instead of asking you for more data, since it seemed to be more of a question on the limitations of R, I found a built-in wide dataset. I still didn't run into the issues you ran into.
I used the data dhfr
from the package caret
. It has over 200 variables; I randomly chose 24.
I didn't clean it. I did look at the influential variables and that is likely going to be an issue. I did this as a way to look for multicollinearity which is a really big problem for linear regression. Since that wasn't a problem, I used this data.
QUESTION
I'm using .NET CORE 3.1 and Newtonsoft.Json to deserialize a JSON response from the API.
this is how the JSON response is structured from the API:
...ANSWER
Answered 2021-Dec-22 at 15:51As what Llama said I was using the wrong attribute for the Serializer that I'm using when I switched [JsonPropertyName]
to [JsonProperty]
from the JSON.NET library the results is as expected.
QUESTION
The EPA CompTox Chemical Dashboard received an update, and my old code is not longer able to scrape the Boiling Point for chemicals. Is anyone able to help me scrape the Experimental Average Boiling Point? I need to be able to write an R code that can loop through several chemicals.
Example webpages:
Acetone: https://comptox.epa.gov/dashboard/chemical/properties/DTXSID8021482
Methane: https://comptox.epa.gov/dashboard/chemical/properties/DTXSID8025545
I have tried read_html()
and xmlParse()
without success. The Experimental Average Boiling Point (ExpAvBP) value does not show up in the XML.
I have tried using ContentScraper()
from the RCrawler
, but it only returns NA whatever I try. Furthermore, this would only work for the first webpage listed, as the cell id changes with each chemical.
ANSWER
Answered 2021-Dec-07 at 16:41As the data is in no table format we have to extract text and extract the boiling temperature by matching pattern BoilingPoint
.
QUESTION
I need to pass multiple filled values to a hidden form field using javascript/jquery. The fields must have a value or don't pass. I can pass the regular text fields with no problem but the checkbox and radio fields always seem to get me. Javascript is not my expertise so I'm willing to learn. Thanks in advance.
The values we are wanting to capture are:
- Questions/comments
- Product Interests (this can be multiple values)
- Industry
- Number of Employees
- Multiple Locations if "true".
Each item will be separated by a pipe character.
...ANSWER
Answered 2021-Dec-06 at 18:09Here's one way. You can just put a change
event listener on the form tag - any changes to the form will trigger the script. The string that gets written into the hidden field is JSON and it can be easily decoded on the back end.
QUESTION
I have a snippet dataset of chemical elements shown below
I want to create a new field called "abundance_rank", where a rank of 1 refers to the highest abundant value (Referring to 'Abundance in Earth's crust' column)
For example, (symbol, abundance_in_earth_crust) with rows (A, 100), (B, 100), (C, 100), (D, 50), the expected records of (symbol, abundance_in_earth_crust, abundance_rank) will be (A, 100, 1), (B, 100, 1), (C, 100, 1), (D, 50, 4). Note that the abundance_rank of D is 4.
I created a new field abundance_rank with the code below
...ANSWER
Answered 2021-Nov-14 at 06:37The RANK()
analytic function would seem to be what you want here:
QUESTION
I have a column in sqlite3 table containing all the chemical elements. There is a column called “Symbol”, where it contains symbols of chemicals. For example, H, Be, Mg.
I would like to pull out all characters from A-Z that does not appear in the column (not case sensitive). Below is what i have currently
...ANSWER
Answered 2021-Nov-13 at 18:16You can use a group concat in your query to get all the symbols in one string, then use a set to hold only the unique letters.
Create a set of the letters of the alphabet and do a symmetric difference operation on them.
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Install chemicals
You can use chemicals like any standard Python library. You will need to make sure that you have a development environment consisting of a Python distribution including header files, a compiler, pip, and git installed. Make sure that your pip, setuptools, and wheel are up to date. When using pip it is generally recommended to install packages in a virtual environment to avoid changes to the system.
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