Rimon Parves

6 Questions 17 Answers 0 Followers

Questions related from Rimon Parves

What is the difference between 6-311G ** ++ and 6-311G (d,p) ++ basis in Gaussian or jaguar software?

I am confused about 6-311G ** ++ and 6-311G (d,p) ++ basis.. both are synonymous or not? if not what is the difference? #Jaguar #gaussain #DFT #Ab-intio

09 September 2017 9,154 4 View

How would I allocate memory and processor for DFT gaussian calculation?

my laptop has corei7 processor and RAM 6 Gb. I want to know about memory and allocation of processor in link tab. last night I tired for 5 core processor and memory 2Gb it said 2070 code...

09 September 2017 5,709 1 View

Gibbs free energy and Thermodynamic stability?

could anyone please explain a bit about relationship between gibbs free energy and thermodynamic stability of a ligand?

09 September 2017 7,596 0 View

What will happen if my drug doesn't follow lipiniski rules

EGCG is a compound which does not follow lipiniski rules, so what to do.. can't I use it as ligand?

08 August 2017 4,586 3 View

APC free publication, is there any international journal where can i publish my research article freely

as i am student and i don't have funding. so i an little bit bemused where should i submit my manuscript for free publication. i am from Bangladesh. is there any opportunity available in any...

08 August 2017 6,156 15 View

How can i perform molecilar dynamics simulation using NAMD/VMD software on win 10

I am eagerly waiting for learning and practicing Molecular dynamics. During practice I can not handle software with it's implementation . please help me about this

07 July 2017 879 6 View