Henry S. Rzepa

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Ana M. LoboProfessor of Organic Chemistry, FCT-UNLVerified email at fct.unl.pt
Egon WillighagenBiGCaT, NUTRIM, Maastricht University/NL, ORCID:0000-0001-7542-0286, https://scholar.social/@egonwVerified email at maastrichtuniversity.nl
Benjamin J WhitakerProfessor of Chemical Physics, University of LeedsVerified email at leeds.ac.uk
Sason ShaikProfessor of Chemistry, Institute of Chemistry, The Hebrew University of JerusalemVerified email at yfaat.ch.huji.ac.il
Alexandra SlawinProfessor of Chemistry,University of St AndrewsVerified email at st-and.ac.uk
Michael McKeeAuburn UniversityVerified email at auburn.edu
D. Christopher BraddockImperial College LondonVerified email at imperial.ac.uk
Julia Contreras-GarcíaCNRS & Sorbonne UniversitéVerified email at lct.jussieu.fr
Christoph SteinbeckFriedrich-Schiller-University JenaVerified email at uni-jena.de
Dr Paul DingwallLecturer in Physical Organic Chemistry, Queen's University BelfastVerified email at qub.ac.uk
Prof. Antoine BuchardRoyal Society University Research Fellow, Professor of Polymer Chemistry, University of BathVerified email at bath.ac.uk
David DanovichInstitute of Chemistry, The Hebrew UniversityVerified email at mail.huji.ac.il
David O'HaganUniversity of St AndrewsVerified email at st-andrews.ac.uk
King Kuok (Mimi) HiiProfessor of Catalysis, Imperial College LondonVerified email at imperial.ac.uk
Geoffrey HutchisonAssociate Professor of Chemistry, University of PittsburghVerified email at pitt.edu
Michael ShaverUniversity of ManchesterVerified email at manchester.ac.uk
Victor W PikeChief of PET Radiopharmaceutical SciencesVerified email at mail.nih.gov
Jim DowningCEO, MetailVerified email at pobox.com
Rajarshi GuhaVertex PharmaceuticalsVerified email at vrtx.com
Fanny CherblancInstitut PasteurVerified email at pasteur.fr

Henry S. Rzepa

Emeritus Professor of Computational Chemistry, Imperial College London

Verified email at imperial.ac.uk - Homepage

Chemistry


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The Blue Obelisk—interoperability in chemical informatics R Guha, MT Howard, GR Hutchison, P Murray-Rust, H Rzepa, ... Journal of chemical information and modeling 46 (3), 991-998, 2006	491	2006
MNDO parameters for third period elements MJS Dewar, ML McKee, HS Rzepa Journal of the American Chemical Society 100 (11), 3607-3607, 1978	454	1978
Some influences of fluorine in bioorganic chemistry HS Rzepa Chemical Communications, 645-652, 1997	368	1997
Möbius aromaticity and delocalization HS Rzepa Chemical reviews 105 (10), 3697-3715, 2005	327	2005
Chemical markup, XML, and the Worldwide Web. 1. Basic principles P Murray-Rust, HS Rzepa Journal of Chemical Information and Computer Sciences 39 (6), 928-942, 1999	291	1999
Synthetic, Structural, Mechanistic, and Computational Studies on Single-Site β-Diketiminate Tin (II) Initiators for the Polymerization of r ac-Lactide AP Dove, VC Gibson, EL Marshall, HS Rzepa, AJP White, DJ Williams Journal of the American Chemical Society 128 (30), 9834-9843, 2006	256	2006
A tricyclic aromatic isomer of hexasilabenzene K Abersfelder, AJP White, HS Rzepa, D Scheschkewitz science 327 (5965), 564-566, 2010	233	2010
Ground states of molecules. 40. MNDO results for molecules containing fluorine MJS Dewar, HS Rzepa Journal of the American Chemical Society 100 (1), 58-67, 1978	225	1978
Tuning azoheteroarene photoswitch performance through heteroaryl design J Calbo, CE Weston, AJP White, HS Rzepa, J Contreras-García, ... Journal of the American Chemical Society 139 (3), 1261-1274, 2017	222	2017
Quadruple bonding in C₂ and analogous eight-valence electron species S Shaik, D Danovich, W Wu, P Su, HS Rzepa, PC Hiberty Nature chemistry 4 (3), 195-200, 2012	221	2012
A Computational Analysis of the Ring-Opening Polymerization of r ac-Lactide Initiated by Single-Site β-Diketiminate Metal Complexes: Defining the Mechanistic Pathway and the … EL Marshall, VC Gibson, HS Rzepa Journal of the American Chemical Society 127 (16), 6048-6051, 2005	213	2005
Chemoselective polymerizations from mixtures of epoxide, lactone, anhydride, and carbon dioxide C Romain, Y Zhu, P Dingwall, S Paul, HS Rzepa, A Buchard, CK Williams Journal of the American Chemical Society 138 (12), 4120-4131, 2016	189	2016
The Houk–List transition states for organocatalytic mechanisms revisited A Armstrong, RA Boto, P Dingwall, J Contreras-Garcia, MJ Harvey, ... Chemical Science 5 (5), 2057-2071, 2014	172	2014
Crocker, not Armit and Robinson, begat the six aromatic electrons AT Balaban, PR Schleyer, HS Rzepa Chemical Reviews 105 (10), 3436-3447, 2005	163	2005
Chemical markup, XML, and the World Wide Web. 4. CML schema P Murray-Rust, HS Rzepa Journal of Chemical Information and Computer Sciences 43 (3), 757-772, 2003	154	2003
Ground states of molecules. 49. MINDO/3 study of the retro-Diels-Alder reaction of cyclohexene MJS Dewar, S Olivella, HS Rzepa Journal of the American Chemical Society 100 (18), 5650-5659, 1978	154	1978
Design, synthesis, and evaluation of a helicenoidal DMAP Lewis base catalyst MR Crittall, HS Rzepa, DR Carbery Organic Letters 13 (5), 1250-1253, 2011	151	2011
Ground states of molecules. 45. MNDO results for molecules containing beryllium MJS Dewar, HS Rzepa Journal of the American Chemical Society 100 (3), 777-784, 1978	148	1978
Calculations of electron affinities using the MNDO semiempirical SCF-MO method MJS Dewar, HS Rzepa Journal of the American Chemical Society 100 (3), 784-790, 1978	147	1978
An X-ray crystallographic, mass spectroscopic, and NMR study of the limonoid insect antifeedant azadirachtin and related derivatives JN Bilton, HB Broughton, PS Jones, SV Ley, HS Rzepa, RN Sheppard, ... Tetrahedron 43 (12), 2805-2815, 1987	139	1987

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