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The Journal of Chemical Physics|September 27, 2006
Molecular tailoring approach for geometry optimization of large molecules: energy evaluation and parallelization strategiesV Ganesh, Rameshwar K Dongare, P Balanarayan, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|May 11, 2026
Extending the Molecular Tailoring Approach for Reliable and Efficient Nuclear Magnetic Resonance Spectral CalculationsSimran Sharma, Subodh S Khire, Shridhar R Gadre, et al.
Organic Letters|July 6, 2002
Electrophilic additions to a 2-methylenebicyclo[2.1.1]hexane system: probing pi-face selectivity for electrostatic and orbital effectsGoverdhan Mehta, S Robindro Singh, P Balanarayan, et al.
Journal of Computational Chemistry|July 24, 2010
Molecular tailoring approach in conjunction with MP2 and Ri-MP2 codes: A comparison with fragment molecular orbital methodAnuja P Rahalkar, Michio Katouda, Shridhar R Gadre, et al.
Physical Chemistry Chemical Physics : PCCP|April 17, 2008
Molecular electrostatic potentials of divalent carbon(0) compoundsMilind M Deshmukh, Shridhar R Gadre, Ralf Tonner, et al.
The Journal of Chemical Physics|June 23, 2025
Assisting calculation of vibrational circular dichroism spectra by molecular tailoring approachSimran Sharma, Subodh S Khire, Shridhar R Gadre, et al.
Physical Chemistry Chemical Physics : PCCP|January 29, 2025
Cyclic cooperativity contributions determine the hydrogen bond strengths in molecular clustersAyush Shivhare, Bharti Dehariya, Shridhar R Gadre, et al.
Physical Chemistry Chemical Physics : PCCP|August 5, 2024
On the synergetic effects of cyclic cooperativity in water clustersAyush Shivhare, Bharti Dehariya, Shridhar R Gadre, et al.
The Journal of Chemical Physics|April 24, 2017
A combined theoretical and experimental study of phenol-(acetylene)n (n ≤ 7) clustersGurmeet Singh, Apurba Nandi, Shridhar R Gadre, et al.
The Journal of Physical Chemistry. A|February 16, 2022
Enabling Rapid and Accurate Construction of CCSD(T)-Level Potential Energy Surface of Large Molecules Using Molecular Tailoring ApproachSubodh S Khire, Nalini D Gurav, Apurba Nandi, et al.
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