November 28, 2024, 09:41:34 PM
Forum Rules: Read This Before Posting


« previous next »
Pages: [1]   Go Down

Topic: Optimizing a ligand through docking  (Read 2344 times)

0 Members and 2 Guests are viewing this topic.

Offline Babcock_Hall

  • Chemist
  • Sr. Member
  • *
  • Posts: 5708
  • Mole Snacks: +330/-24
Optimizing a ligand through docking
« on: June 19, 2020, 09:09:49 AM »
We are doing some covalent docking studies.  Now that we have the results, how do we go about improving our compounds to bind more strongly?  Is it done intuitively or is there a systematic way to work?  I am a docking neophyte.
Logged

Offline Babcock_Hall

  • Chemist
  • Sr. Member
  • *
  • Posts: 5708
  • Mole Snacks: +330/-24
Re: Optimizing a ligand through docking
« Reply #1 on: July 20, 2020, 03:15:30 PM »
I am still working my way through this topic, including the jargon.  I have some articles now on hit-to-lead optimization.
Logged
Pages: [1]   Go Up
« previous next »
Sponsored Links