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Most cited papers from Wallingford Public Library

What are the most cited papers from Wallingford Public Library?

The most cited paper from Wallingford Public Library is "Geometries and properties of excited states in the gas phase and in solution: Theory and application of a time-dependent density functional theory polarizable continuum model" (Giovanni Scalmani, Michael J. Frisch, Benedetta Mennucci et al., 2006), with 1,416 citations. Next come "Elotuzumab Therapy for Relapsed or Refractory Multiple Myeloma" (1,340) and "A state-specific polarizable continuum model time dependent density functional theory method for excited state calculations in solution" (850).

Showing 50 of 61 papers. Every paper with more than 16 citations is listed.

Most cited papers, sortable by citations and release date
#Paper
1 Geometries and properties of excited states in the gas phase and in solution: Theory and application of a time-dependent density functional theory polarizable continuum model Giovanni Scalmani, Michael J. Frisch, Benedetta Mennucci et al. · The Journal of Chemical Physics 28 Feb 2006 1,416
2 Elotuzumab Therapy for Relapsed or Refractory Multiple Myeloma Sagar Lonial et al. · New England Journal of Medicine Open access 2 Jun 2015 1,340
3 A state-specific polarizable continuum model time dependent density functional theory method for excited state calculations in solution Roberto Improta, Vincenzo Barone, Giovanni Scalmani et al. · The Journal of Chemical Physics 2 Aug 2006 850
4 Preliminary Study of Two Antiviral Agents for Hepatitis C Genotype 1 Anna S. Lok, David Gardiner, Eric Lawitz et al. · New England Journal of Medicine Open access 18 Jan 2012 610
5 Formation and relaxation of excited states in solution: A new time dependent polarizable continuum model based on time dependent density functional theory Marco Caricato, Benedetta Mennucci, Jacopo Tomasi et al. · The Journal of Chemical Physics 28 Mar 2006 608
6 Toward effective and reliable fluorescence energies in solution by a new state specific polarizable continuum model time dependent density functional theory approach Roberto Improta, Giovanni Scalmani, Michael J. Frisch et al. · The Journal of Chemical Physics 17 Aug 2007 520
7 Energy-Represented Direct Inversion in the Iterative Subspace within a Hybrid Geometry Optimization Method Xiaosong Li, Michael J. Frisch · Journal of Chemical Theory and Computation 18 Apr 2006 482
8 Computational molecular spectroscopy Vincenzo Barone, Silvia Alessandrini, Małgorzata Biczysko et al. · Nature Reviews Methods Primers ReviewOpen access 27 May 2021 423
9 The incidence of adverse drug events in two large academic long-term care facilities Jerry H. Gurwitz, Terry S. Field, James O. Judge et al. · The American Journal of Medicine Mar 2005 406
10 Ab initio Ehrenfest dynamics Xiaosong Li, John C. Tully, H. Bernhard Schlegel et al. · The Journal of Chemical Physics 22 Aug 2005 386
11 Assessment of the efficiency of long-range corrected functionals for some properties of large compounds Denis Jacquemin, Éric A. Perpète, Giovanni Scalmani et al. · The Journal of Chemical Physics 11 Apr 2007 303
12 A restricted-open-shell complete-basis-set model chemistry Geoffrey P. F. Wood, Leo Radom, George A. Petersson et al. · The Journal of Chemical Physics 5 Sep 2006 250
13 Efficient evaluation of short-range Hartree-Fock exchange in large molecules and periodic systems Artur F. Izmaylov, Gustavo E. Scuseria, Michael J. Frisch · The Journal of Chemical Physics 8 Sep 2006 232
14 Optimization of CAMD techniques 3. Virtual screening enrichment studies: a help or hindrance in tool selection? Andrew C. Good, Tudor Ionel Oprea · Journal of Computer-Aided Molecular Design 8 Jan 2008 182
15 Nutritional Status and Bacterial Binding in the Lower Respiratory Tract in Patients with Chronic Tracheostomy Michael S. Niederman, William W. Merrill, R Ferranti et al. · Annals of Internal Medicine Jun 1984 152
16 Monoclonal antibody drug immunoconjugates for targeted treatment of cancer Pamela A. Trail, Dalton H. King, Gene M. Dubowchik · Cancer Immunology Immunotherapy Open access May 2003 129
17 Demographic, Clinical, and Treatment Parameters Influencing the Outcome of Acute Cystitis ROGER M. ECHOLS, Robert L. Tosiello, Daniel C. Haverstock et al. · Clinical Infectious Diseases Jul 1999 108
18 QM:QM electronic embedding using Mulliken atomic charges: Energies and analytic gradients in an ONIOM framework Hrant P. Hratchian, Priya V. Parandekar, Krishnan Raghavachari et al. · The Journal of Chemical Physics 16 Jan 2008 105
19 Nonequilibrium Fermi golden rule for electronic transitions through conical intersections Artur F. Izmaylov, David Mendive‐Tapia, Michael J. Bearpark et al. · The Journal of Chemical Physics 19 Dec 2011 101
20 Prediction in catchment hydrology Robin T. Clarke · Journal of Hydrology Aug 1978 91
21 Outcome Analysis of Carotid Endarterectomy in Connecticut: The Impact of Volume and Specialty Steven T. Ruby, Diane C. Robinson, John T. Lynch et al. · Annals of Vascular Surgery 1996 88
22 Anabolic-Androgenic Steroids and Psychiatric-Related Effects: A Review * Leo Uzych · The Canadian Journal of Psychiatry Feb 1992 88
23 The Evolution of Diagnosis-Related Groups (DRGs) Norbert Goldfield · Quality Management in Health Care 2010 87
24 The relation between chemically measured total iron-binding capacity concentrations and immunologically measured transferrin concentrations in human serum Raymond Gambino, E. Desvarieux, Michael Orth et al. · Clinical Chemistry Dec 1997 86
25 Retinoic Acid Receptor Gamma Mediates Topical Retinoid Efficacy and Irritation in Animal Models Simon D.M. Chen, Jacek Ostrowski, Gary S. Whiting et al. · Journal of Investigative Dermatology Open access May 1995 71
26 Double hybrids and time‐dependent density functional theory: An implementation and benchmark on charge transfer excited states Alistar Ottochian, Carmela Morgillo, Ilaria Ciofini et al. · Journal of Computational Chemistry 19 Feb 2020 65
27 Practical Density Functionals beyond the Overdelocalization–Underbinding Zero-Sum Game Benjamin G. Janesko, Emil I. Proynov, Jing Kong et al. · The Journal of Physical Chemistry Letters 24 Aug 2017 63
28 Valproic Acid–Induced Parkinsonism in the Elderly: A Comprehensive Review of the Literature Fade Aziz Mahmoud, Rajesh R. Tampi · ˜The œAmerican journal of geriatric pharmacotherapy 16 Oct 2011 61
29 ONIOM-based QM:QM electronic embedding method using Löwdin atomic charges: Energies and analytic gradients Nicholas J. Mayhall, Krishnan Raghavachari, Hrant P. Hratchian · The Journal of Chemical Physics 15 Mar 2010 56
30 Large Solvation Effect in the Optical Rotatory Dispersion of Norbornenone Priyanka Lahiri, Kenneth B. Wiberg, Patrick H. Vaccaro et al. · Angewandte Chemie International Edition 16 Dec 2013 53
31 Derivation of the Exponential Relation for the Effect of Ellipsoidal Porosity on Elastic Modulus Clarence A. Andersson · Journal of the American Ceramic Society Aug 1996 50
32 Molecular Genetic Analysis of a Human Neuropeptide Y Receptor Patricia M. Rose, Jean S. Lynch, Scott T. Frazier et al. · Journal of Biological Chemistry Open access Feb 1997 49
33 Factors Attracting and Keeping Nurses in Home Care Ann Anthony, Paula F. Milone-Nuzzo · Home Healthcare Now Jun 2005 48
34 Automatically generated Coulomb fitting basis sets: Design and accuracy for systems containing H to Kr Rui Liang Yang, Alistair P. L. Rendell, Michael J. Frisch · The Journal of Chemical Physics Open access 15 Aug 2007 46
35 Efficient Geometry Minimization and Transition Structure Optimization Using Interpolated Potential Energy Surfaces and Iteratively Updated Hessians Jingjing Zheng, Michael J. Frisch · Journal of Chemical Theory and Computation 18 Oct 2017 44
36 On the Driving Force of the Excited-State Proton Shuttle in the Green Fluorescent Protein: A Time-Dependent Density Functional Theory (TD-DFT) Study of the Intrinsic Reaction Path Alessio Petrone, Paola Cimino, Greta Donati et al. · Journal of Chemical Theory and Computation 29 Aug 2016 43
37 Serine 232 and Methionine 272 Define the Ligand Binding Pocket in Retinoic Acid Receptor Subtypes Jacek Ostrowski, Thor Roalsvig, Laura A. Hammer et al. · Journal of Biological Chemistry Open access Feb 1998 43
38 Zidovudine Treatment in Patients with Primary (Acute) Human Immunodeficiency Virus Type 1 Infection: A Randomized, Double-Blind, Placebo-Controlled Trial Manette T. Niu, James Bethel, Mark Holodniy et al. · The Journal of Infectious Diseases Jul 1998 38
39 Assessing challenging intra‐ and inter‐molecular charge‐transfer excitations energies with double‐hybrid density functionals Éric A. G. Brémond, Alistar Ottochian, Ángel José Pérez-Jiménez et al. · Journal of Computational Chemistry 21 Mar 2021 36
40 M11plus: A Range-Separated Hybrid Meta Functional with Both Local and Rung-3.5 Correlation Terms and High Across-the-Board Accuracy for Chemical Applications Pragya Verma, Benjamin G. Janesko, Ying Wang et al. · Journal of Chemical Theory and Computation Open access 5 Aug 2019 36
41 Material hardship is associated with posttraumatic stress disorder symptoms among low‐income Black women Samantha C. Holmes, Laura S. Callinan, Vanessa C. Facemire et al. · Journal of Traumatic Stress Open access Oct 2021 35
42 Origins of halogen effects in bioorthogonal sydnone cycloadditions Huimin Tao, Fang Liu, Ruxin Zeng et al. · Chemical Communications Open access 2018 35
43 Pharmacokinetics and Pharmacodynamics of Atazanavir‐containing Antiretroviral Regimens, with or without Ritonavir, in Patients who are HIV ‐positive and Treatment‐naïve Richard Bertz, Anna Persson, Ellen M. Chung et al. · Pharmacotherapy The Journal of Human Pharmacology and Drug Therapy Mar 2013 35
44 The in vitro activity of BMS-284756, a new des-fluorinated quinolone T.M.A. Weller · Journal of Antimicrobial Chemotherapy 2002 34
45 Reservoir capacity and yield Alan Gustard · Journal of Hydrology Nov 1979 30
46 Long-range-corrected Rung 3.5 density functional approximations Benjamin G. Janesko, Emil I. Proynov, Giovanni Scalmani et al. · The Journal of Chemical Physics 13 Mar 2018 29
47 Theoretical studies on the stability of molecular platinum catalysts for hydrogen production Lindsay E. Roy, Giovanni Scalmani, Rika Kobayashi et al. · Dalton Transactions Open access 2009 29
48 Development of the ICD-10 procedure coding system (ICD-10-PCS). Averill Rf, Mullin Rl, Steinbeck Ba et al. · PubMed Feb 2001 27
49 A comparison of some properties of C=O and C=S bonds Kenneth B. Wiberg, Yigui Wang · ARKIVOC Open access 14 Nov 2010 25
50 A High-Content Glucocorticoid Receptor Translocation Assay for Compound Mechanism-of-Action Evaluation Michele L. Agler, Margaret M. Prack, Yingjie Zhu et al. · SLAS DISCOVERY Open access 7 Nov 2007 25

Citations are OpenAlex's own counts, from its 2026-09-23 snapshot, so the ranking can differ from Google Scholar or Web of Science. A paper is listed for an institution when any of its authors gave it as an affiliation; retracted papers and papers whose citation count cannot be traced to citing works are left out, and a preprint and the article it became are shown once. Release dates are OpenAlex's: where a source gave only a month or a year, that is what is shown. How the lists are chosen.