Pratim Kumar Chattaraj

Publication Activity (10 Years)

Years Active: 2007-2024
Publications (10 Years): 13

Top Topics

Welding Process

Generative Model

Video Representation

Top Venues

J. Comput. Chem.

J. Mach. Learn. Res.

Publications

Himangshu Mondal, Pratim Kumar Chattaraj
reduction using aluminum hydride: Generation of in-situ frustrated Lewis pairs and small molecule activation therein. J. Comput. Chem. 45 (14) (2024)
Ranita Pal, Pratim Kumar Chattaraj
Electrophilicity index revisited. J. Comput. Chem. 44 (3) (2023)
Sukanta Mondal, Gourhari Jana, Hemant Kumar Srivastava, Garikapati Narahari Sastry, Pratim Kumar Chattaraj
Structure and stability of the sH binary hydrate cavity and host-guest versus guest-guest interactions therein: A DFT approach. J. Comput. Chem. 44 (15) (2023)
Prasenjit Das, Pratim Kumar Chattaraj
CSiGaAl2-/0 and CGeGaAl2-/0 having planar tetracoordinate carbon atoms in their global minimum energy structures. J. Comput. Chem. 43 (13) (2022)
Gourhari Jana, Pratim Kumar Chattaraj
Effect of substitution on the bonding in He dimer confined within dodecahedrane: A computational study. J. Comput. Chem. 41 (28) (2020)
Prasenjit Das, Ranajit Saha, Pratim Kumar Chattaraj
Encapsulation of Mg2 inside a C60 cage forms an electride. J. Comput. Chem. 41 (17) (2020)
Bidisha Samanta, Abir De, Gourhari Jana, Vicenç Gómez, Pratim Kumar Chattaraj, Niloy Ganguly, Manuel Gomez-Rodriguez
NEVAE: A Deep Generative Model for Molecular Graphs. J. Mach. Learn. Res. 21 (2020)
Bidisha Samanta, Abir De, Gourhari Jana, Pratim Kumar Chattaraj, Niloy Ganguly, Manuel Gomez Rodriguez
NeVAE: A Deep Generative Model for Molecular Graphs. AAAI (2019)
Debdutta Chakraborty, Pratim Kumar Chattaraj
Reactions involving some gas molecules through sequestration on Al12Be cluster: An electron density based study. J. Comput. Chem. 39 (10) (2018)
Debdutta Chakraborty, Pratim Kumar Chattaraj
Host-guest interactions between octa acid and cations/nucleobases. J. Comput. Chem. 39 (3) (2018)
Debdutta Chakraborty, Pratim Kumar Chattaraj
Confinement induced thermodynamic and kinetic facilitation of some Diels-Alder reactions inside a CB[7] cavitand. J. Comput. Chem. 39 (3) (2018)
Sudip Pan, Diego Moreno, Sreyan Ghosh, Pratim Kumar Chattaraj, Gabriel Merino
Structure and stability of noble gas bound EX3+ compounds (E = C, Ge, Sn, Pb; X = H, F, Cl, Br). J. Comput. Chem. 37 (2) (2016)
Manas Ghara, Sudip Pan, Anand Kumar, Gabriel Merino, Pratim Kumar Chattaraj
Structure, stability, and nature of bonding in carbon monoxide bound EX3+ complexes (E = group 14 element; X = H, F, Cl, Br, I). J. Comput. Chem. 37 (24) (2016)
Sudip Pan, Ashutosh Gupta, Ranajit Saha, Gabriel Merino, Pratim Kumar Chattaraj
A coupled-cluster study on the noble gas binding ability of metal cyanides versus metal halides (metal = Cu, Ag, Au). J. Comput. Chem. 36 (29) (2015)
Sudip Pan, Santanab Giri, Pratim Kumar Chattaraj
A computational study on the hydrogen adsorption capacity of various lithium - Doped boron hydrides. J. Comput. Chem. 33 (4) (2012)
Ashutosh Kumar Gupta, Arindam Chakraborty, Santanab Giri, Venkatesan Subramanian, Pratim Kumar Chattaraj
Toxicity of Halogen, Sulfur and Chlorinated Aromatic Compounds: A Quantitative-Structure-Toxicity-Relationship (QSTR). Int. J. Chemoinformatics Chem. Eng. 1 (1) (2011)
Santanab Giri, Debesh Ranjan Roy, Soma Duley, Arindam Chakraborty, Ramakrishnan Parthasarathi, Munusamy Elango, Ramadoss Vijayaraj, Venkatesan Subramanian, Rafael Islas, Gabriel Merino, Pratim Kumar Chattaraj
Bonding, aromaticity, and structure of trigonal dianion metal clusters. J. Comput. Chem. 31 (9) (2010)
Snehadrinarayan Khatua, Debesh Ranjan Roy, Manish Bhattacharjee, Pratim Kumar Chattaraj
Aromaticity in alkali metal clusters: Role of the metalloligand and the size of the metal ion. J. Comput. Methods Sci. Eng. 7 (5-6) (2007)