Lamthaka Willingson

8 Questions 8 Answers 0 Followers

Questions related from Lamthaka Willingson

How do I solve the termination of the program running for NBO analysis in Gaussian?

I have run the program for Counterpoise correction for BSSE, but the program got terminated, saying "The combination of multiplicity 1 and 205 electrons is impossible". How do I solve this issue?

last month 1,521 1 View

How do i solve the problem in the docking?

I've attach the image displaying my problem after docking process is over. The problem arises when I try to view the docking results in the Biovia Discovery studio. Please help me to solve the issue.

25 April 2025 6,652 1 View

How to install and used Gar2ped?

I want to install Gar2ped software for vibrational assignment. How do i do?

25 April 2025 8,211 0 View

How Can I Synthesiezed cisplatin +Adenine biomolecular complex?

Help me out - Methodology for the synthesis of cisplatin +Adenine biomolecular complex

09 December 2024 1,845 2 View

How can i study the carboplatin using spectroscopic technique, viz Raman and FTIR spectroscopy?

I'm working on carboplatin which i bought from local pharmacy. It is a Carboplatin injection IP 150mg/15ml which is sterile aqueous solution for intravenous use. Unfortunately, I cannot able to...

05 August 2024 573 3 View

Can someone help me molecular docking using autodock 4.2.6 tool?

i'm carrying out molecular docking for a compound containing metal, Platinum, with 3T6A protein using Autodock 4.2.6 tool. However, i cannot run Autogrid to obtain .dpf file which i'm going to...

29 June 2024 7,094 7 View

Is the DFT calculation of metal-biomolecular complex using split (GEN) basis set same as the calculation using B3LYP/LANL2DZ?

I'm working on metal-biomolecular complex. So, i've tried the optimization using split (GEN) basis set by adding additional keyword - Pseudo=Read. However, the program died after few seconds,...

21 May 2024 5,165 0 View

How can i run the program for DFT calculations using Gaussian?

I'm a fresh research scholar working on DFT, where i used Gaussian for computational method. Currently, i'm working on water-silver complex. But i cannot run the program as it shows error which...

17 May 2024 1,977 7 View