diff --git a/client-app/src/components/AboutComponent.js b/client-app/src/components/AboutComponent.js index 3d359da4..0b7b85ad 100644 --- a/client-app/src/components/AboutComponent.js +++ b/client-app/src/components/AboutComponent.js @@ -6,7 +6,7 @@ const AboutComponent = () => { return (
-

About

+

About Electronic Structure Parser

Our web application specializes in extracting specific details from chemistry log files. Users can effortlessly search for information by entering a search term, enabling @@ -14,6 +14,16 @@ const AboutComponent = () => { downloading the extracted data as a Word document, ensuring seamless accessibility and usability.

+

+ Access the application here:{" "} + + Electronic Structure Parser + +

Example Inputs and Outputs

- Output: Extracted data in `output.docx` containing the first occurrence of `CARTESIAN COORDINATES` in sections 1-5. + Output: Extracted data in `output.docx` containing the first occurrence of `CARTESIAN COORDINATES` in section 1.
  • Input 2: @@ -33,9 +43,9 @@ const AboutComponent = () => {
  • Uploaded File: ORCA log file with molecular energy data
  • Search Terms: `TOTAL ENERGY, FINAL GRADIENT`
  • Line Specification: `WHOLE`
  • -
  • Sections: `2`
  • +
  • Sections: `1,2`
  • - Output: Extracted data in `output.docx` containing all lines with `TOTAL ENERGY` and `FINAL GRADIENT` from sections 2 and 4. + Output: Extracted data in `output.docx` containing all lines with `TOTAL ENERGY` and `FINAL GRADIENT` from sections 1 and 2. @@ -53,7 +63,7 @@ const AboutComponent = () => {

    Key Features