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0
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34
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How does the interaction between an existing anti-inflammatory drug and its target protein contribute to the therapeutic effect of the drug?
answered
Feb 28
in
Medicinal Chemistry
0
votes
40
views
What is the theoretical value of the magnetic susceptibility of a given organic molecule under certain conditions, and what factors contribute to this value?
answered
Feb 28
in
Quantum Chemistry
0
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45
views
What is the theoretical calculation of the absorption spectrum of a molecule, and what are the specific electronic transitions responsible for each peak in the spectrum?
answered
Feb 28
in
Quantum Chemistry
0
votes
40
views
What is the theoretical basis for the electronic and optical properties of graphene and other 2D materials, and how can quantum chemical calculations be used to predict and understand these properties?
answered
Feb 28
in
Quantum Chemistry
0
votes
64
views
What is the theoretical basis for predicting the chemical reactivity and selectivity of a given molecule using quantum chemical calculations?
answered
Feb 28
in
Quantum Chemistry
0
votes
36
views
How does the temperature affect the structure and behavior of a lipid bilayer membrane in molecular dynamics simulations?
answered
Feb 28
in
Computational Chemistry
0
votes
46
views
How does the temperature affect the orientational order of liquid crystals as predicted by Monte Carlo simulations?
answered
Feb 28
in
Computational Chemistry
0
votes
27
views
How does the temperature affect the energy transfer processes and molecular dynamics in a gas-phase reaction between methane and oxygen using quantum chemistry calculations?
answered
Feb 28
in
Quantum Chemistry
0
votes
39
views
How does the temperature affect the adsorption of gas molecules on activated charcoal?
answered
Feb 28
in
Surface Chemistry
0
votes
39
views
How does the temperature affect the adsorption of gas molecules on a solid surface?
answered
Feb 28
in
Surface Chemistry
0
votes
39
views
How does the temperature affect the self-organization and structure of phospholipid bilayers in molecular dynamics simulations?
answered
Feb 28
in
Computational Chemistry
0
votes
36
views
How does the temperature affect the phase transition behavior of a liquid crystal using Monte Carlo simulations?
answered
Feb 28
in
Computational Chemistry
0
votes
51
views
How does the temperature affect the nematic ordering of a liquid crystal sample simulated through Monte Carlo simulations?
answered
Feb 28
in
Computational Chemistry
0
votes
47
views
How does the temperature affect the order parameter and phase transition of the nematic phase of a liquid crystal system using Monte Carlo simulations?
answered
Feb 28
in
Computational Chemistry
0
votes
30
views
How does the temperature affect the conformational behavior of a polymer chain in a Monte Carlo simulation?
answered
Feb 28
in
Computational Chemistry
0
votes
35
views
How does the temperature of the system affect the outcomes of Monte Carlo simulations of gas-phase reactions?
answered
Feb 28
in
Computational Chemistry
0
votes
42
views
How does the temperature of a system affect the energy transfer processes and molecular dynamics of a gas-phase reaction?
answered
Feb 28
in
Quantum Chemistry
0
votes
32
views
How does the temperature of a solvent affect the rate of energy transfer in a chemical reaction? Use quantum chemistry methods to model molecular dynamics and analyze the energy transfer processes.
answered
Feb 28
in
Quantum Chemistry
0
votes
39
views
How does the temperature affect the reaction rate and profitability of the reaction between hydrochloric acid and magnesium ribbon?
answered
Feb 28
in
Chemical kinetics
0
votes
33
views
How does the temperature affect the rate of reaction in the reaction between sodium thiosulfate and hydrochloric acid?
answered
Feb 28
in
Chemical kinetics
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