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Hello, I used PyTraj to plot a Ramachandran plot for a protein, but the plot contains so many residues that it’s difficult to analyze. Is there a more straightforward way to interpret the plot and...
13 January 2025 3,308 1 View
Correct the name of one co author incorrectly published
03 January 2025 4,303 1 View
I have a list of compounds that came up after LC-MS/MS experiments for untargetted metabolomics. I do not have the KEGG IDs or HMDB IDs for those compounds. When I input this list in the online...
26 December 2024 8,778 1 View
Dear useres, I'll be most thankful for any help with the following matter: While running Gaussian 16, opt+freq with CCSD(T) and mixed basis sets, I keep getting zero for all IR intensities. This...
25 December 2024 8,145 0 View
How does the circadian rhythm impact plant growth and flowering time?
08 December 2024 1,524 1 View
I am looking to measure lung wet/dry weight ratio and do the Evan's blue permeability assay in neonatal rats treated with LPS (inflammatory injury) and drug treatment to determine the...
05 December 2024 949 0 View
using maize and okra as examples
27 November 2024 3,074 4 View
Does anyone have an idea how to prepare MRS agar from MRS broth powder (by adding agar power to the MRS broth)? does this work and the resulting MRS agar allow the growth of LAB? Cordially
02 November 2024 8,599 0 View
Please how to select topics for Schiff Base derivative?
10 October 2024 6,268 4 View
Hello everyone, I am a chemistry student working on my graduation project focusing on transition metal acetylacetonate complexes, specifically Fe, Mn, and Cu. I am looking for the best solvents...
02 October 2024 5,702 2 View
I synthesized Co(II) triazole Schiff base complex using Co(II) acetate tetrahydrate in 2:1 ratio (L:M). The ligand is synthesized from 3-amino-5-mercapto-1,2,4-triazole with benzaldehyde...
30 September 2024 418 4 View
I am researching on the environmental impacts of soilless strawberries, cultivated in coconut fiber. However, we ere not able to gather experimental data on field. Hence, to estimate emissions we...
30 September 2024 5,240 3 View
Hello, can anyone please tell me how to setup GPU to run MD simulations in Schrodinger Maestro in Windows 11? My laptop is running Windows 11 and I want to do MD simulations but when I try to run...
27 September 2024 6,066 3 View
Reactants are soluble in only ACN, DMSO and DMF and my product should be insoluble in ACN. The imine bond forming is highly sensitive to water and I tried using Molecular sieves it break when I...
26 September 2024 8,839 2 View
Hello everyone, I am currently working on a molecular docking project and have obtained results that I need help interpreting. I would greatly appreciate any guidance on how to analyze these...
19 September 2024 2,554 3 View
I am working on different nanocomposites in my project. I am facing difficulties while checking for the removal of heavy metal from the water. Can anyone please suggest me a simple process to...
07 August 2024 1,006 2 View
How can I extract secondary metabolites from dried samples?
05 August 2024 1,264 3 View
i need to know more about the Schiff base formation if the aldehyde is less electrophile and the amine is less nucleophile, they have nitro group in para position and even the two aldehyde and...
31 July 2024 6,558 2 View
here is my scf.in file and scf.out file. I am new to quantum espresso and really need help. thanks
22 July 2024 919 3 View
hello I start work in analyze lab with FT-IR instrument I am sending the pictures of some of the samples that have been sent to the laboratory for analysis. I wanted to know if it is possible for...
11 June 2024 8,808 1 View
Hi, Attached here is the CIF file of CaCO3. I have opened it using Vesta and get the following data: %%%%%%%%%%% Title C Ca O3 Lattice type C Space group name Custom Space...
15 May 2024 6,699 5 View
I want to make n-type and p-type GaN devices as inverters and simulate them by Mixedmode. However, it always turns out to be wrong. With the warning: no solution possible. I want to know what the...
13 May 2024 4,550 1 View
Hello everyone! I made a solid dispersion of valsartan using PEG 6000 and Kollidon VA64 as polymers, prepared by solvent evaporation method. For characterization, I checked my sample using FTIR...
12 May 2024 4,743 4 View
We aim to devise a technique for estimating 4-alkoxyacetanilides and their analogues by initially transforming them into the respective anilines. These anilines would then undergo diazotization...
30 April 2024 1,766 0 View