| 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), 2006 | 290 | 2006 |
| Enabling ab initio Hessian and frequency calculations of large molecules AP Rahalkar, V Ganesh, SR Gadre The Journal of Chemical Physics 129 (23), 2008 | 90 | 2008 |
| 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 | 86 | 2006 |
| 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 | 81 | 2004 |
| 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 | 67 | 2010 |
| 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 | 67 | 2004 |
| 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 | 41 | 2011 |
| MeTA studio: A cross platform, programmable IDE for computational chemist V Ganesh Journal of computational chemistry 30 (4), 661-672, 2009 | 28 | 2009 |
| 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 | 16 | 2009 |
| 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 | 13 | 2008 |
| 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 | 11 | 2011 |
| 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 | 5 | 2009 |
| Ab initio treatment of large molecular systems: algorithm development, parallelization and applications V Ganesh Pune, 2010 | 1 | 2010 |
| Fast Food for the Computational Chemist!(A programmable cross-platform environment for computational chemists) V Ganesh | | 2009 |
| Fast Food for Computational Chemists! V Ganesh | | |
Shridhar GadreDistinguished Professor, SPPU, PuneVerified email at iitk.ac.in
