% csauthors.net - beta - BibTeX bibliography of Shridhar R. Gadre
@article{journals/candc/GadreBS91,
title = {Computation of Molecular Electrostatic Potential: an Efficient Algorithm and Parallelization.},
year = {1991},
journal = {Comput. Chem.},
author = {{Shridhar R. Gadre} and {Sangeeta Bapat} and {Indira Shrivastava}}
}
@article{journals/jcc/ShirsatLG93,
title = {Development of a restricted Hartree - Fock program INDMOL on PARAM: A highly parallel computer.},
year = {1993},
journal = {J. Comput. Chem.},
author = {{Rajendra N. Shirsat} and {Ajay C. Limaye} and {Shridhar R. Gadre}}
}
@article{journals/jcc/BabuG03,
title = {Ab initio quality one-electron properties of large molecules: Development and testing of molecular tailoring approach.},
year = {2003},
journal = {J. Comput. Chem.},
author = {{K. Babu} and {Shridhar R. Gadre}}
}
@article{journals/jcc/Gadre03,
title = {Foreword.},
year = {2003},
journal = {J. Comput. Chem.},
author = {{Shridhar R. Gadre}}
}
@article{journals/jcc/GaneshKRG08,
title = {WebProp: Web interface for ab initio calculation of molecular one-electron properties.},
year = {2008},
journal = {J. Comput. Chem.},
author = {{V. Ganesh} and {Ritwik Kavathekar} and {Anuja P. Rahalkar} and {Shridhar R. Gadre}}
}
@article{journals/jcc/KavathekarKGRG09,
title = {WebMTA: A web-interface for ab initio geometry optimization of large molecules using molecular tailoring approach.},
year = {2009},
journal = {J. Comput. Chem.},
author = {{Ritwik Kavathekar} and {Subodh Khire} and {V. Ganesh} and {Anuja P. Rahalkar} and {Shridhar R. Gadre}}
}
@article{journals/jcc/RahalkarKGN10,
title = {Molecular tailoring approach in conjunction with MP2 and Ri-MP2 codes: A comparison with fragment molecular orbital method.},
year = {2010},
journal = {J. Comput. Chem.},
author = {{Anuja P. Rahalkar} and {Michio Katouda} and {Shridhar R. Gadre} and {Shigeru Nagase}}
}
@article{journals/jcc/DeshmukhBG11,
title = {Intramolecular hydrogen bond energy and cooperative interactions in α-, β-, and γ-cyclodextrin conformers.},
year = {2011},
journal = {J. Comput. Chem.},
author = {{Milind M. Deshmukh} and {Libero J. Bartolotti} and {Shridhar R. Gadre}}
}
@article{journals/jcc/KumarYGLRREZ15,
title = {DAMQT 2.1.0: A new version of the DAMQT package enabled with the topographical analysis of electron density and electrostatic potential in molecules.},
year = {2015},
journal = {J. Comput. Chem.},
author = {{Anmol Kumar} and {Sachin D. Yeole} and {Shridhar R. Gadre} and {Rafael López} and {Jaime Fernández Rico} and {Guillermo Ramírez} and {Ignacio Ema} and {David Zorrilla}}
}
@article{journals/cphysics/LopezRREZKYG17,
title = {Topology of molecular electron density and electrostatic potential with DAMQT.},
year = {2017},
journal = {Comput. Phys. Commun.},
author = {{Rafael López} and {Jaime Fernández Rico} and {Guillermo Ramírez} and {Ignacio Ema} and {David Zorrilla} and {Anmol Kumar} and {Sachin D. Yeole} and {Shridhar R. Gadre}}
}
@article{journals/cphysics/MeenaGB18,
title = {PAREMD: A parallel program for the evaluation of momentum space properties of atoms and molecules.},
year = {2018},
journal = {Comput. Phys. Commun.},
author = {{Deep Raj Meena} and {Shridhar R. Gadre} and {P. Balanarayan}}
}
@article{journals/jcc/BijinaSG18,
title = {Electrostatics for probing lone pairs and their interactions.},
year = {2018},
journal = {J. Comput. Chem.},
author = {{Padinjare Veetil Bijina} and {Cherumuttathu H. Suresh} and {Shridhar R. Gadre}}
}
@article{journals/jcc/GadreS18,
title = {Preface.},
year = {2018},
journal = {J. Comput. Chem.},
author = {{Shridhar R. Gadre} and {C. H. Suresh}}
}
@article{journals/cphysics/KhireSG22,
title = {MTASpec software for calculating the vibrational IR and Raman spectra of large molecules at ab initio level.},
year = {2022},
journal = {Comput. Phys. Commun.},
author = {{Subodh Khire} and {Nityananda Sahu} and {Shridhar R. Gadre}}
}
@article{journals/cphysics/KumarLMREZYG22,
title = {DAMQT 3: Advanced suite for the analysis of molecular density and related properties in large systems.},
year = {2022},
journal = {Comput. Phys. Commun.},
author = {{Anmol Kumar} and {Rafael López} and {Frank Martinez} and {Guillermo Ramírez} and {Ignacio Ema} and {David Zorrilla} and {Sachin D. Yeole} and {Shridhar R. Gadre}}
}
@article{journals/jcc/KhireG23,
title = {Development and testing of an algorithm for efficient MP2/CCSD(T) energy estimation of molecular clusters with the 2-body approach.},
year = {2023},
month = {January},
journal = {J. Comput. Chem.},
author = {{Subodh Khire} and {Shridhar R. Gadre}}
}
@article{journals/jcc/AhirwarKGD24,
title = {Hydrogen bond energy estimation (H-BEE) in large molecular clusters: A Python program for quantum chemical investigations.},
year = {2024},
journal = {J. Comput. Chem.},
author = {{Mini Bharati Ahirwar} and {Subodh Khire} and {Shridhar R. Gadre} and {Milind M. Deshmukh}}
}