molecular docking technique

USAGE SUMMARY

The phrase "molecular docking technique" is correct and usable in written English.
You can use it in scientific or research contexts, particularly in biochemistry or pharmacology, to describe a method for predicting the interaction between molecules. Example: "The molecular docking technique allows researchers to visualize how a drug molecule binds to its target protein."

✓ Grammatically correct

Science

Human-verified examples from authoritative sources

Exact Expressions

8 human-written examples

To explain the dual inhibition of MAO-B and AA2AR at the molecular level, molecular docking technique was employed.

Journal of Young Pharmacists

Consequently, a molecular docking technique was run on a library of novel discontinuous peptides predicted by PEPOP from Human epidermal growth factor receptor 2 (HECD ECD) subdomain III.

Computational Biology and Chemistry

The interactions of complexes 1 4 with human serum albumin (HSA) have been investigated in Tris HCl buffer solution at pH 7.4 by spectroscopic methods and a molecular docking technique.

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

We present three interaction zones (zones vide −1 to −3) in the colchicine binding domain of Haemonchus contortus (a helminth) β-tubulin homology model and developed zone-wise structure-based pharmacophore models coupled with molecular docking technique to unveil the binding hypotheses.

Computational Biology and Chemistry

To this aim, at first, Co (III) DiAmsar was synthesized and characterized by nuclear magnetic resonance (NMR), and mass spectroscopy and then its interaction with HSA and BSA was investigated by means of various spectroscopic methods (Fourier transform infrared (FT-IR), UV visible (UV vis), fluorescence, and cyclic voltammetry (CV)) and molecular docking technique.

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

The molecular docking technique was also utilized to ascertain the mechanism and mode of action of diphenyltin analog 3. The in vitro antitumor activity of 3 was evaluated by SRB assay against a panel of human cancer cell lines which clearly revealed good cytotoxic activity against K-562 human leukemic cells with GI50 values <10 μg/ml.

Journal of Organometallic Chemistry

Human-verified similar examples from authoritative sources

Similar Expressions

52 human-written examples

In this study a group of polyphenolic compounds was evaluated as potential inhibitors of arginine kinase using molecular docking techniques.

International Journal of Biological Macromolecules

Further, the molecular mechanism underlying the inhibition of tyrosinse by amoxicillin was investigated by means of fluorescence quenching and molecular docking techniques.

International Journal of Biological Macromolecules

Hence, the binding of harmine with sequence specific DNA oligonucleotides has been studied using various biophysical techniques i.e. absorption, fluorescence and molecular docking techniques.

Chemico-Biological Interactions

In this paper, the inhibitory kinetics of glabridin on tyrosinase and their binding mechanisms were determined using spectroscopic, zebrafish model and molecular docking techniques.

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

DNA-binding study of 3f with sm-DNA was probed through UV vis absorption, fluorescence quenching, gel electrophoresis and molecular docking techniques.

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

Expert writing Tips

Best practice

When describing your research, clearly specify the software and scoring functions used in your "molecular docking technique" to ensure reproducibility.

Common error

Avoid making definitive claims about binding affinity solely based on "molecular docking technique" results; always validate findings with experimental data due to the inherent limitations of computational models.

Linguistic Context

The phrase "molecular docking technique" functions as a noun phrase, typically serving as the subject or object in a sentence. It identifies a specific method used in computational chemistry and structural biology as Ludwig examples suggest.

Expression frequency: Uncommon

Frequent in

Science

100%

Less common in

News & Media

0%

Formal & Business

0%

Academia

0%

Ludwig's WRAP-UP

The phrase "molecular docking technique" is a grammatically sound noun phrase commonly found in scientific contexts. Ludwig AI confirms its correctness and usability. It refers to a specific computational method used to predict the interaction between molecules. While its frequency is uncommon, it is essential in fields like computational biology and drug discovery. Related phrases include "docking simulation method" and "computational docking approach". Best practices involve specifying software and scoring functions, while common errors include overgeneralizing results without experimental validation. The phrase serves to inform and explain scientific methodologies in a formal, scientific register.

More alternative expressions

Phrases that express similar concepts, ordered by semantic similarity:

virtual molecular docking

Describes the process being virtually implemented.

molecular docking methodology

Refers to the overall method used in molecular docking.

ligand-protein docking technique

Specifically mentions the interaction between a ligand and a protein.

drug-receptor docking technique

Focuses on docking between drug and receptor molecules.

docking simulation method

Focuses on the simulation aspect of molecular docking.

computational docking approach

Emphasizes the computational nature of the docking process.

computational drug docking

Emphasizes the usage of molecular docking technique for drug design.

in silico docking procedure

Highlights the use of computer simulations in the docking procedure.

computer-aided docking method

Highlights the assistance of computers in the docking process.

structure-based docking strategy

Highlights the importance of structural information in the docking process.

FAQs

How is the "molecular docking technique" used in drug discovery?

The "molecular docking technique" is used to predict how a drug molecule will interact with its target protein, helping researchers identify potential drug candidates and optimize their design.

What are the limitations of using the "molecular docking technique"?

Limitations include the accuracy of force fields, the representation of protein flexibility, and the ability to accurately model solvent effects. Experimental validation is essential to confirm docking predictions.

What software is commonly used for performing "molecular docking technique"?

Common software includes AutoDock, Vina, GOLD, and Schrödinger's Glide. Each has its strengths and weaknesses, so choosing the right one depends on the specific application.

What's the difference between "molecular docking" and "molecular dynamics"?

"Molecular docking" predicts the preferred orientation of one molecule to another when bound to form a stable complex. "Molecular dynamics" simulates the physical movements of atoms and molecules, allowing for the study of dynamic behavior of molecular systems over time.