What are the techniques to find out optimal result?

More Prakhar Modi's questions See All

Not able to give GAFF forcefield to my ligand?

I have been able to assign the CHARMM forcefield to my ligand i.e. acetyl coenzyme A but not the amber forcefield. I want to run amber forcefield and the parameterization of ligand is failing. I...

15 July 2024 7,323 1 View

While doing docking using Autodock1.5.7, I am getting a warning that there are non integral charges on my ligand. How to remove it?

I used Autodock for docking, due to the non integral charges on my ligand I am not able to dock with the protein. How to dock the file?

08 June 2024 5,593 2 View

Investigation on structural, hysteresis, Mössbauer properties and electrical parameters in X-type Ba2Co2ErxFe28-xO46 hexaferrites?

Conducted an extensive study on hexaferrites, substituting Erbium into X-type Ba2Co2ErxFe28-xO46 through a precise heat treatment process. XRD analysis highlighted phase variations, showcasing...

16 November 2023 2,147 2 View

Which is the best software for the simulation of thermal runaway propagation in EV batteries?

Thermal runaway propagation

28 September 2023 1,051 0 View

Zotero abbreviated Journal names?

I am currently working on a paper written in LaTeX and am trying to obtain abbreviated journal names in the references. Using the built-in tools in Zotero, I can get abbreviations for a few...

10 September 2023 2,702 0 View

How do I report a security concern?

Someone is trying to create a new account using my email. An activation request was forwarded to me to activate the email account severally earlier, and even today by 08:06am.

30 July 2023 9,835 0 View

What is the purpose of research?

R&D

15 July 2023 6,967 1 View

What are the main considerations for minimizing interference and improving signal quality in antenna systems ?

Minimizing interference and improving signal quality in antenna...

08 July 2023 8,362 2 View

I'm facing problem in NO determination using Griess reagent of SRL ?

for standard i have prepared 10 mM stock and diluted (10 -1200 micromolar) added SRL Griess reagent placed 15 min incubation in dark in to various concentration for the standard graph preparation...

28 May 2023 586 0 View

How can I change the resolution of my python code output graphs and other output screenshots for publishing in a scientific paper?

I have tried the free resolution software online and also Adobe Photoshop but just improving the dpi of raster images doesn't improve its quality and make it a vector image that is suitable for...

09 May 2023 6,288 3 View

Difficulty with permittivitt and Magnetic Permeability Calculations?

Difficulty with permittivitt and Magnetic Permeability Calculations Hello everyone, I have all the parameters related to the calculations of the permittivitty and magnetic permeability...

30 July 2024 5,206 1 View

How to use Desmond in HPC ?

Our department has recently acquired an HPC (High-Performance Computing) system, and I'm thrilled to take my molecular dynamics calculations to the next level using Desmond. I used to run my...

28 July 2024 6,553 1 View

All math can be explained by iterator of code?

all math can be traversed by code? all math can be translate to code?

26 July 2024 9,530 0 View

What is human-computer interaction (HCI)?

22 July 2024 10,056 2 View

Which are the Scopus Indexed Journals in Computer Science with short review time?

Hello, I am looking out for Scopus Indexed Journals in Computer Science with short review time and short time to publish after acceptance (with / without APC). Please mention the journals that you...

19 July 2024 4,250 2 View

How can I download an article to my computer?

I have tried sharing, but it only provide a list of persons that does not include me. When I click on the download button, it does not seem to download it to my computer. Thank you

19 July 2024 1,814 3 View

How to extract binding energy from pv.maegz file without using Schrodinger?

I have conducted virtual screening using Schrödinger on a database of 17,000 molecules. Unfortunately, I cannot use the system with the Schrödinger license at the moment. I am trying to find a way...

18 July 2024 2,881 4 View

How can I extract the mathematical equation from existing Neural Network Model?

There exists a neural network model designed to predict a specific output, detailed in a published article. The model comprises 14 inputs, each normalized with minimum and maximum parameters...

14 July 2024 2,714 3 View

Could anyone please guide me on to proceed to apply for phd ?

Hi Everyone , I finished my Master's in Computer Science . I have work experince in IT services and learning cloud tech . I am not a good programmer (Can do if needed) . I like scripting...

10 July 2024 267 0 View

What should I upgrade in my computer to speed up simulation in CST?

I want to reduce simulation time in CST for frequency domain solver by upgrading my computer. I already have discrete GPU but it doesn't seem to make any difference at all compared to integreted...

10 July 2024 2,789 4 View

Renaud Di Francesco

You need to define your outcomes as vectors x. Then you need an objective function U(x), in economics it's called utility. Then you find your optimum as x* maximising U(x) on x

Jeff Bouchard

At my old government job we used good old OLAP Cubes for those cases, I'd be interested to know if anyone has better tools also