K. V. Jovan Jose - Publications, H-index & Citations

K. V. Jovan Jose

university of hyderabad

20H指数

55论文数

1.4K被引数

收录论文 24

发表时间

Spectral-directed electrostatics strategy integrated within a graph neural network approach for the prediction of nanocluster structures 基于图神经网络方法的谱导向静电策略用于预测纳米团簇结构

Physical Chemistry Chemical Physics

IF2.9

2026-08-19

PREAI

Sridatri Nandy; K. V. Jovan Jose Corresponding Author

A Chameleon-like Core-Shell Organic/Lanthanide Flexible Crystal Waveguide for Bandwidth and Colour Tunability 变色龙状核壳有机/镧系柔性晶体波导用于带宽和颜色可调性

chem. sci.

IF0

2026-05-29

OAAI

Melchi Chosenyah; Mehdi Rohullah; Vinod Avulu; K. V. Jovan Jose; Rajadurai Chandrasekar

In-silico exploration of potential indoleamine 2,3-dioxygenase-1 inhibitors: An insight from docking, ADME and molecular dynamic simulations 潜在的吲哚胺2，3-双加氧酶-1抑制剂的计算机模拟探索: 来自对接，ADME和分子动力学模拟的见解

JOURNAL OF THE INDIAN CHEMICAL SOCIETY

IF3.4

2025-02-01

PREAI

Zargar, Zahid Bashir; Rana, Priyanka; Singh, Rahul; Kaur, Manpreet; Mande, Srinivasarao; Jose, K. V. Jovan; Salunke, Deepak B.; Dhingra, Neelima; Pawar, Sandip, V

Directed Electrostatics Strategy Integrated as a Graph Neural Network Approach for Accelerated Cluster Structure Prediction

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2025-01-15

PREAI

Nandy, Sridatri; Jose, K. V. Jovan

Cascading Effect of Large Molecular Motion in Crystals: A Topotactic Polymorphic Transition Paves the Way to Topochemical Polymerization

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

IF15.6

2023-04-20

PREAI

Raju, Cijil; Ramteke, Gunjan R.; Jose, K. V. Jovan; Sureshan, Kana M.

1,2-Phenylene-Incorporated Smallest Expanded Calix[4]pyrrole via One-Step Synthesis of Tetrapyrrane: A Fluorescent Host for Fluoride Ion

JOURNAL OF ORGANIC CHEMISTRY

IF3.6

2021-07-28

PREAI

Kumar, B. Sathish; Chandra, Brijesh; Jose, K. V. Jovan; Panda, Pradeepta K.

A2B- and A3-Type Boron(III)Subchlorins Derived from meso-Diethoxycarbonyltripyrrane: Synthesis and Photophysical Exploration

JOURNAL OF ORGANIC CHEMISTRY

IF3.6

2021-07-15

PREAI

Soman, Rahul; Chandra, Brijesh; Bhat, Ishfaq A.; Kumar, B. Sathish; Hossain, Sk Saddam; Nandy, Sridatri; Jose, K. V. Jovan; Panda, Pradeepta K.

Spatiotemporal Growth Anomalies in Photoisomerizable Cyanostilbene-Based Crystals Triggered by Light

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2021-02-23

PREAI

Kumar, Avulu Vinod; Annadhasan, Mari; Pradeep, Vuppu Vinay; Jyothi, Mane; Jose, K. V. Jovan; Chandrasekar, Rajadurai

Carbazole-based π-conjugated 2,2′-Bipyridines, a new class of organic chromophores: Photophysical, ultrafast nonlinear optical and computational studies

DYES AND PIGMENTS

IF4.2

2021-02-01

PREAI

Bodapati, Ramakrishna; Dey, Gaurav Ranjan; Ramteke, Gunjan R.; Krishnakanth, Katturi Naga; Rao, S. Venugopal; Jose, K. V. Jovan; Das, Samar K.

Meso-Free Boron(III)subchlorin and Its μ-Oxo Dimer with Interacting Chromophores

ORGANIC LETTERS

IF5

2020-12-03

PREAI

Chandra, Brijesh; Soman, Rahul; Kumar, B. Sathish; Jose, K. V. Jovan; Panda, Pradeepta K.

Synthetic access to calix[3]pyrroles via meso-expansion: hosts with diverse guest chemistry

CHEMICAL COMMUNICATIONS

IF4.2

2020-01-01

PREAI

Kumar, B. Sathish; Pati, Narendra N.; Jose, K. V. Jovan; Panda, Pradeepta K.

Fragment-Based Approaches for Supramolecular Interaction Energies: Applications to Foldamers and Their Complexes with Anions

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2018-11-28

PREAI

Debnath, Sibali; Sengupta, Arkajyoti; Jose, K. V. Jovan; Raghavachari, Krishnan

Iodo-Cycloisomerization of Aryl(indol-3-yl)methane-Tethered Propargyl Alcohols to 3-lodocarbazoles via Selective 1,2-Alkyl Migration

ACS OMEGA

IF4.3

2018-11-07

OAAI

Yaragorla, Srinivasarao; Bag, Debojyoti; Dada, Ravikrishna; Jose, K. V. Jovan

Assessment of Fragmentation Strategies for Large Proteins Using the Multilayer Molecules-in-Molecules Approach

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2018-02-16

PREAI

Thapa, Bishnu; Beckett, Daniel; Jose, K. V. Jovan; Raghavachari, Krishnan

Cooperative Formation of Icosahedral Proline Clusters from Dimers

JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY

IF2.7

2017-11-10

OAAI

Jacobs, Alexander D.; Jose, K. V. Jovan; Horness, Rachel; Raghavachari, Krishnan; Thielges, Megan C.; Clemmer, David E.

Fragment-Based Approach for the Evaluation of NMR Chemical Shifts for Large Biomolecules Incorporating the Effects of the Solvent Environment

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2017-02-14

OAAI

Joset, K. V. Jovan; Raghavachari, Krishnan

Raman Optical Activity Spectra for Large Molecules through Molecules-in-Molecules Fragment-Based Approach

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2016-01-13

PREAI

Jose, K. V. Jovan; Raghavachari, Krishnan

Vibrational Circular Dichroism Spectra for Large Molecules through Molecules-in-Molecules Fragment-Based Approach

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2015-08-19

PREAI

Jose, K. V. Jovan; Beckett, Daniel; Raghavachari, Krishnan

Evaluation of Energy Gradients and Infrared Vibrational Spectra through Molecules-in-Molecules Fragment-Based Approach

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2015-02-26

PREAI

Jose, K. V. Jovan; Raghavachari, Krishnan

Electrostatic Potential-Based Method of Balancing Charge Transfer Across ONIOM QM:QM Boundaries

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2014-09-15

PREAI

Jose, K. V. Jovan; Raghavachari, Krishnan

研究方向