Shefin Basheera

5 Questions 15 Answers 0 Followers

Questions related from Shefin Basheera

Can someone help me out in calculating the mmpbsa of a protein-ligand complex?

I have completed the md simulation of protein ligand complex using Gromacs I am a newbie to gromacs .. Linux, but executed successfully. I would be grateful if someone could help me out. Thank...

22 March 2022 696 6 View

Error when tried to assemble .tpr file using grompp command...Can someone look into this to see what went wrong with my files?

I successfully generated the complex.gro file, then created the box the solvated as well. but when i used grompp to assemble a .tpr file, using .mdp file. i met with error. I have attached the...

10 December 2021 1,244 9 View

How to save the stream file of ligand generated through cgenff in .str format?

In Ligand topology generation, I am unable to save .str file generated through cgenff webserver. I could save it in .txt format only.

26 October 2021 3,866 6 View

GCMS Analysis reg. Are all phthalate dervied compounds from GC-MS analysis of plant extracts are artificial??

Are all phthalate derivatives obtained from GC-MS analysis of plant extracts are products of GC column products

01 January 1970 646 18 View

International Conference on life science

May I know the upcoming international conferences/symposiums happening in USA in the field of Lifescience/ Nutraceuticals / Biotechnology/Computer aided drug discovery Thank you

01 January 1970 6,380 7 View