Mal Ahmed Ali

6 Questions 1 Answers 0 Followers

Questions related from Mal Ahmed Ali

How can I calculate the polarizability using MOPAC?

Your toughest technical questions will likely get answered within 48 hours on ResearchGate, the professional network for scientists.

05 May 2016 4,797 0 View

Is there any correction for the lower electron affinity that got from semiempirical method?

Your toughest technical questions will likely get answered within 48 hours on ResearchGate, the professional network for scientists.

04 April 2016 523 0 View

IS polarizabilities computed automatically via RM1 or i should calculate it ?

if polarizabilities not computed automatically, how I calculate it? thanks

04 April 2016 6,100 0 View

How can i calculate the electronegativity for molecule from semiempirical method?

I need the equation that used to calculate electronegativity for semiempirical method

04 April 2016 5,361 1 View

Is there any website or book that have experiment data of ionization potential and electron affinity of bio molecules?

Is there any website or book that have experiment data of ionization potential and electron affinity of biomolecules ، please, help if you know. Thanks

12 December 2015 2,299 2 View

How can i calculate HOMO and LUOM for bioisoteres using Avogadro software and MOPAC?

08 August 2015 527 1 View