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Ganesh V
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Molecular tailoring approach for geometry optimization of large molecules: Energy evaluation and parallelization strategies
V Ganesh, RK Dongare, P Balanarayan, SR Gadre
The Journal of chemical physics 125 (10), 104109, 2006
2562006
Enabling ab initio Hessian and frequency calculations of large molecules
AP Rahalkar, V Ganesh, SR Gadre
The Journal of Chemical Physics 129 (23), 234101, 2008
872008
Tailoring approach for exploring electron densities and electrostatic potentials of molecular crystals
K Babu, V Ganesh, SR Gadre, NE Ghermani
Theoretical Chemistry Accounts 111, 255-263, 2004
802004
Molecular tailoring approach: towards PC-based ab initio treatment of large molecules
SR Gadre, V Ganesh
Journal of Theoretical and Computational Chemistry 5 (4), 2006
772006
Validity of current force fields for simulations on boron nitride nanotubes
TA Hilder, R Yang, V Ganesh, D Gordon, A Bliznyuk, AP Rendell, ...
Micro & Nano Letters 5 (2), 150-156, 2010
612010
Many-body interaction analysis: Algorithm development and application to large molecular clusters
AD Kulkarni, V Ganesh, SR Gadre
The Journal of chemical physics 121 (11), 5043-5050, 2004
612004
X10 as a parallel language for scientific computation: Practice and experience
J Milthorpe, V Ganesh, AP Rendell, D Grove
2011 IEEE International Parallel & Distributed Processing Symposium, 1080-1088, 2011
402011
MeTA studio: A cross platform, programmable IDE for computational chemist
V Ganesh
Journal of computational chemistry 30 (4), 661-672, 2009
252009
WebMTA: A web‐interface for ab initio geometry optimization of large molecules using molecular tailoring approach
R Kavathekar, S Khire, V Ganesh, AP Rahalkar, SR Gadre
Journal of computational chemistry 30 (7), 1167-1173, 2009
152009
WebProp: Web interface for ab initio calculation of molecular one‐electron properties
V Ganesh, R Kavathekar, A Rahalkar, SR Gadre
Journal of computational chemistry 29 (3), 488-495, 2008
122008
Molecular Tailoring: An Art of the Possible for Ab Initio Treatment of Large Molecules and Molecular Clusters
AP Rahalkar, SD Yeole, V Ganesh, SR Gadre
Linear-Scaling Techniques in Computational Chemistry and Physics: Methods …, 2011
102011
An overview on applications of SwissADME web tool in the design and development of anticancer, antitubercular and antimicrobial agents: A medicinal chemist's perspective
B Bakchi, AD Krishna, E Sreecharan, VBJ Ganesh, M Niharika, ...
Journal of Molecular Structure, 132712, 2022
82022
Use of Cluster OpenMP with the Gaussian Quantum Chemistry Code: A Preliminary Performance Analysis
R Yang, J Cai, AP Rendell, V Ganesh
Evolving OpenMP in an Age of Extreme Parallelism: 5th International Workshop …, 2009
52009
Fast Food for the Computational Chemist!(A programmable cross-platform environment for computational chemists)
V Ganesh
2009
Synthesis and characterization of pure and cobalt Doped Gallium Nitride Nanocrystals
V Ganesh
Chennai, 0
Fast Food for Computational Chemists!
V Ganesh
Ab Initio Treatment of Large Molecular Systems: Algorithm Development, Parallelization and Applications
V Ganesh
Pune, 0
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