Personal information

Other IDs

SciProfiles: 1559257
Scopus Author ID: 57214456282

Keywords

Computational chemistry, Astrochemistry, Drug designing, Quantum mechanics

Countries

India

Biography

Research Scholar, VIT, Vellore

Activities

Collapse all

Works (10)

Systematic Computational Approaches on Biosorption of Fluoride on Chitin: Crossover from Conventional to Short and Strong Hydrogen Bonds

ACS ES&T Water
2024-12-13 | Journal article
DOI: 10.1021/acsestwater.4c00496
Contributors: Abdul Hamid Malhan; Nisha Job; Ann Maria Francis; Masthan Thamim; Gopalan Viswanathan; Pandian Bothi Raja; S. K. Ashok Kumar; Krishnan Thirumoorthy
Source: check_circle
Crossref

Silicon Chemistry in the Interstellar Medium and Circumstellar Envelopes

ACS Earth and Space Chemistry
2024-03-21 | Journal article
DOI: 10.1021/acsearthspacechem.3c00284
Contributors: Nisha Job; Krishnan Thirumoorthy
Source: check_circle
Crossref

Theoretical Studies on the Isomerization Kinetics of Low-Lying Isomers of the SiC4H2 System

The Journal of Physical Chemistry A
2024-01-11 | Journal article
DOI: 10.1021/acs.jpca.3c05658
Contributors: Nisha Job; Vijayanand Chandrasekaran; Venkatesan S. Thimmakondu; Krishnan Thirumoorthy
Source: check_circle
Crossref
grade
Preferred source (of 2)‎

In Silico Drug Design and Analysis of Dual Amyloid-Beta and Tau Protein-Aggregation Inhibitors for Alzheimer’s Disease Treatment

Molecules
2023-02-01 | Journal article
DOI: 10.3390/molecules28031388
Contributors: Nisha Job; Venkatesan S. Thimmakondu; Krishnan Thirumoorthy
Source: check_circle
Crossref
grade
Preferred source (of 3)‎

Chemical Bonding Perspective on Low-Lying SiC4H2 Isomers: Conceptual Quantum Chemical Views

The Journal of Physical Chemistry A
2022-12-22 | Journal article
DOI: 10.1021/acs.jpca.2c06230
Contributors: Nisha Job; Krishnan Thirumoorthy
Source: check_circle
Crossref
grade
Preferred source (of 2)‎

Al<sub>2</sub>C<sub>4</sub>H<sub>2</sub> Isomers with the Planar Tetracoordinate Carbon (ptC)/Aluminum (ptAl)

Atoms
2022-10 | Journal article | Author
DOI: 10.3390/atoms10040112
Contributors: Abdul Hamid Malhan; Sony Sobinson; NISHA JOB; Shilpa Shajan; Surya Prakash Mohanty; Venkatesan S. Thimmakondu; Krishnan Thirumoorthy
Source: check_circle
Multidisciplinary Digital Publishing Institute
grade
Preferred source (of 3)‎

Why Are MgC3H Isomers Missing in the Interstellar Medium?

The Journal of Physical Chemistry A
2022-07-14 | Journal article
DOI: 10.1021/acs.jpca.2c02220
Contributors: Sunanda Panda; Devipriya Sivadasan; Nisha Job; Aland Sinjari; Krishnan Thirumoorthy; Anakuthil Anoop; Venkatesan S. Thimmakondu
Source: check_circle
Crossref
grade
Preferred source (of 2)‎

CAl<sub>4</sub>Mg<sup>0/−</sup>: Global Minima with a Planar Tetracoordinate Carbon Atom

Atoms
2021-04 | Journal article | Author
DOI: 10.3390/atoms9020024
Contributors: NISHA JOB; Maya Khatun; Krishnan Thirumoorthy; S SANKHAR REDDY Ch; Vijayanand Chandrasekaran; Anakuthil Anoop; Venkatesan S. Thimmakondu
Source: check_circle
Multidisciplinary Digital Publishing Institute
grade
Preferred source (of 3)‎

Directionality of Pb 2+ lone pair electrons dictated hemi‐directed coordination mode of methyl‐ and ferrocenylcarboxylate complexes

Applied Organometallic Chemistry
2020-04 | Journal article
DOI: 10.1002/aoc.5537
Part of ISSN: 0268-2605
Part of ISSN: 1099-0739
Source: Self-asserted source
NISHA JOB
grade
Preferred source (of 2)‎

Theoretical Studies of SiC4H2 Isomers Delineate Three Low-Lying Silylidenes Are Missing in the Laboratory.

The journal of physical chemistry. A
2020-01-23 | Journal article
DOI: 10.1021/acs.jpca.9b11742
PMID: 31904236
Source: Self-asserted source
NISHA JOB
grade
Preferred source (of 2)‎
How many people are using ORCID?