AAE AAF AAM AAO AAP AAW AAgren AB ABP ABQ ABS ACA ACB ACC ACH ACI ACK ACL ACP ACR ACS ADB ADE ADM ADP AE AEC AED AEE AEI AEL AEP AER AET AF AFA AFCa AFCb AFN AFO AFP AGC AGP AGS AHC AHE AHP AIA AIB AIE AIS AKADEMIE AKS ALA ALC ALM ALS ALX AMB AMC AME AMO AMQ AMS AMT ANC ANE ANM ANO AOP APB APC APG API APP APS APSG APW AQM AQT AQW AR ARF ARI ARR ASA ASC ASFa ASFb ASG ASI ASIF ASM ASQ ASR AST ASW ATD ATF ATL ATM ATP ATS AUG AUS AVC AVP AWR Aa Aage Aagren Aasbrink Aatto Ab Abbas Abdou Abdul Abdullah Abdulnur Abel Abha Absar Abu Ac Acetaldehyde Achenbach Acknowledgement Acta Adachi Adalberto Adamowicz Adamson Adawi Addassi Adel Adelman Adelsindo Adions Ae Aerts Af Ag Aggarwal Aguilar Ahad Aharonov Ahlrichs Ahmad Ahmed Ahmet Ai Aida Aiken Aissing Aizman Aj Ajit Ak Akademie Akagi Akiko Akinori Akira Akitomo Akiva AlH Ala Alagona Alain Alameddine Alaor Alberte Albertsen Alejandro Aleksandar Aleksander Aleksandr Aleksandra Alessandro Alexandru Alf Alfred Alfredo Alger Alkylation Allouche Alm Alml Almlof Almon Alonso Alternant Altmann Alves Amaldi Ames Amore Amrit Amsterdem Anachkova Analyses Ananchenkov Anand Anchell Andarias Anders Andersson Andini Andoni Andr Andrada Andrade Andrea Andreas Andreev Andrej Andrey Andriotis Andrzej Andzelm Ang Angeloni Angelov Angelova Anil Anisimov Anjali Anjan Anjuli Anmin Annette Annik Anomeric Antigonish Antisymmetrizer Antonio Antonsen Aoki Aponte Appellof Apr Ar ArH ArN ArO Aray Archimedean Archirel Arduengo Ari Arickx Arie Armando Arnau Arne Aroyo Arseneau Arteca Artes Arturo Arup Arvind Aryloxy Asai Ascorbate Ashoke Aspromallis Assali Astrid Atabek Atri Atsushi Au Auerbach Aufsatzsammlung Augustin Aull Avellanet Avery Avoird Avron Axe Axel Azhary Azizul Azman Azua B BA BAA BAM BAP BBA BBD BBE BBP BCC BCL BCP BCQ BCS BCl BDA BDM BDS BEAL BEI BEM BENCUM BEP BF BFGS BFS BH BIBSYS BIR BLA BLAa BLAb BLD BLR BM BMP BMS BMT BMV BO BOC BOT BOV BOVa BOVb BPF BPM BQM BR BRB BRBa BRBb BRBc BRBd BRC BRD BRE BRF BRG BRI BRM BRP BRQ BRR BRS BRT BRU BSB BSC BSD BSE BSF BSG BSP BSQ BSR BSS BSSE BTF BTU BUTTERWORTHS BW BWF BZD BZT Ba BaC BaTiO Baba Babi Bacic Bacskay Badenhoop Bader Baer Baerends Bagaturjants Bagaturyants Bagayoko Bagnall Bagus Bair Baird Bajaj Bakale Bakhshi Balaban Balaji Balasubramanian Balb Balbas Balbir Baldo Balint Baltensperger Bamzai Bandarage Banerjee Bansal Bao Baraff Barak Barandiaran Barbier Bardo Baretty Barnett Barone Barranco Barrera Barrie Barrio Bartell Bartolotti Bartolucci Barysz Barzaghi Basch Basilevsky Bastida Battaglia Baughman Bauschlicher Bayard Baykara Baylis BeAl BeBH BeH Becke Becker Bedian Beebe Behi Behnam Bei Bela Beleznay Belinda Belinfante Belinskii Bellido Bendale Bendazzoli Bene Benedek Benedetto Bengt Benovic Benzenoid Benzinger Benzodiazepin Benzophenone Beran Berggren Bernab Bernd Bernhard Berrondo Berthier Bertholon Bertoluzza Bertr Bertran Besnainou Besnik Bessis Beswick Bettolo Beveridge Beyer Beznosjuk Bhacca Bhargava Bhatia Bhattacharjee Bhattacharyya Bhaumik Bhowmik Bianchi BibTeX Bibliographie Bichsel Bicine Bickerstaff Bicz Biczo Bigelow Bigham Bindal Binkley Binning Biomolecules Biquadratic Birge Birner Birte Biskupi Biskupic Biswas Bj Bla Blagoy Blaha Bleick Bloch Blomberg Bloor Blum Blumenau Bo Boca Bodart Bodor Boehm Boer Boerrigter Boerth Boettger Boeuve Bogang Bogdan Bogdanov Boggs Bogumi Bohm Boldyrev Bolis Bonaccorsi Bonacic Bonapasta Bonchev Bonham Bonilla Bonnouvrier Borel Borello Boris Borisevitch Borka Borkman Borodavkin Bossa Bottcher Boubekeur Boucekkine Boudreaux Bouhm Boulanger Bouma Bouman Bourg Boyd Boyle Bozovic Br Braga Brandas Brandemark Brandi Brandow Brandt Brauchler Bravais Bredas Bregadze Breit Brener Brenner Brenstein Brescansin Brett Brewster Brickmann Bridet Briels Brillouin Brimfield Brinda Brion Brito Broc Brocas Broch Brochon Broclawik Broeckhove Broer Broglie Bronis Bronislav Bronislaw Broo Brouck Brower Brownstein Broyde Broyles Brucenta Bruggemann Bruijn Brumer Buchler Buckingham Budowsky Buenker Bulski Bunce Bunge Burke Bussery Butadiene Buthus Butterworths C CA CAA CAF CAH CAO CAS CASSCF CAU CBA CBB CBC CBE CBH CBI CBM CBN CBO CBP CBR CBS CBT CC CCA CCB CCC CCD CCE CCG CCH CCI CCK CCM CCO CCP CCR CCS CCSD CCT CCW CCl CD CDAa CDAb CDE CDF CDH CDM CDP CDS CDT CDU CEA CED CEE CEH CEL CEM CEP CES CET CEW CF CFA CFB CFE CFM CFO CFP CFS CGA CGB CGC CGE CGF CGFa CGFb CGI CGS CGT CH CHC CHCH CHE CHF CHI CHP CHR CHS CI CIC CID CIF CIH CII CIM CIP CIQ CIR CIS CISDT CISDTQ CIT CLARENDON CLD CLF CLI CLM CLN CLQ CMA CMB CMC CMD CME CMEa CMEb CMI CMO CMP CMS CN CNA CNC CNDO CNF CNI CNM CNT CNW CO COA CODEN COE COL COM COS COU CPC CPD CPE CPG CPH CPI CPM CPP CPR CPS CPT CPW CQC CQM CQS CRC CRH CRO CRP CRQ CRS CS CSA CSB CSC CSD CSE CSF CSFs CSH CSI CSL CSM CSO CSP CSQ CSR CSS CSU CSV CT CTA CTB CTBa CTBb CTC CTD CTE CTG CTI CTM CTN CTP CTR CTT CUDa CUDb CULLEN CUS CVC CVP CXA CXS CYBER Ca Cabrerizo Cabrol Cai Calai Calais Calazans Calcul Callaway Callis Calvo Calzada Cameron Cammi Campillo Campos Campoy Candelaria Canuto Cao Capellos Cappello Carb Carbo Carcinogenesis Carcinogenicity Carcinogens Cardelino Cardenas Careri Carlo Carlos Carlsson Carmelo Caron Carrington Carsey Carsky Cary Casaubon Casida Casta Castano Castelli Castells Castiglione Castillo Catalyse Catecholamine Caterina Cation Catledge Catlow Caudano CdS CdTe Cederbaum Cedillo Ceferino Celso Centre Centrum Ceperley Ch Cha Chabalowski Chacham Chaer Chaguri Chai Chaikovskii Chakraborty Chalasinaski Chambaud Chan Chanchal Chandler Chandra Chandrasekhar Chandrasekharan Chandrashekhar Changying Chantranupong Chao Charbonneau Chatelier Chatterjee Chaturvedi Chatzidimitriou Chaudhary Chaves Cheeseman Cheetham Chekhov Chelikowsky Chem Chemica Chemie Chemisorption Chemometrics Cheney Cheng Chengzheng Cherayathumadom Chergui Chermette Chertov Chi Chia Chiang Chiara Chichester Chidambaram Chikayoshi Chimie Ching Chiral Chiu Cho Chojnacki Cholesky Chong Chongmoon Christensen Christina Christoffel Christoffersen Christophorov Christos Christov Chu Chui Chuljian Chun Chung Chunwan Ciambelli Cianetti Cieplak Ciftan Cimiraglia Cioslowski Cis Cisneros Cizek Cl ClF ClN ClNCO Clabo Claes Claessens Clancy Clarendon Clary Clas Claverie Clayton Cleantes Cleanthes Clebsch Clementi Climenhaga Co CoF CoXF Cochran Coene Coffman Cogordan Colditz Coldwell Cole Coli Colin Collado Colle Collins Collisional Colpa Comeau Compadre Compton Concetto Condon Conformons Cong Conghao Congr Constanciel Contreras Cooley Coplan Corbin Corfu Cornelia Cornelius Corongiu Corr CorreaDeMello Correia Corwin Coulombic Coulson Cowan Cowburn Coxeter Cr CrC CrGe CrSi Crick Crippen Crist Croatia Croatica Crossley Crowther Cs CsO Csa Csanak Csaszar Csavinszky Csizmadia Cu CuCl CuF CuO Cui Culberson Cullen Cummings Cumulant Cundari Cunha Curtiss Cvita Cvitas Cycloadditions Cyclodextrins Cytochrome Czermi Czerminski Czerwinski Czuchajowski D DAC DAE DAI DATB DBS DCC DCE DCH DCI DCK DCL DCM DCN DCP DCR DCS DCl DDE DDI DDM DDQ DDR DDS DDT DDV DEA DEE DEM DEP DER DES DFB DFC DFI DFR DFT DGE DHK DIMa DIMb DJM DLG DMA DMB DMC DMD DME DMF DMM DMN DMP DMS DNB DNC DNJ DOI DP DPE DPS DPT DRA DRC DRD DRM DRS DSA DSB DSC DSE DSI DSL DSO DSS DST DSW DTF DTS DV DVB DVM DVR DW DWBA DWF DWT DX Da DaCunhaLima DaSilva Dafna Dagata Dage Dagher Dagys Dahl Dai Dal DalCappello Dalgaard Dalsgaard Damburg Damhus Damnjanovi Danail Dancoff Danilov Danuta Dao Darden Darryl Darvesh Das Dashevsky Dateo Datseff Datta Datzeff Daudel Daudey Daul Davydov Dayashankar De DeBrouckere DeHosson Deak Deb Debashis Debendra Debye Decai Decoret Deepak Defina Defranceschi Defrees Degeneracy Dehalle Del DelBene DelRe Delano Deleeuw Delgado Delhalle Delos Demelo Demian Demiralp Dence Deng Denner Der Derecskei Derek Dermot Deshmukh Detrich Deumens Devarajan Devashis Devreese Dhingra Di Diabatic Diamagnetism Dianzani Diarmid Dias Diaz Didier Diels Diercksen Diestler Dijkman Dilip Dimaprit Dimethylnitrosamine Dina Dinesha Dirichlet Divincenzo Dixon Diz Dmitriev Doggett Dolg Dolin Domcke Donati Donini Donnamaria Donnelly Dordrccht Dordrecht Dordrect Doren Doreste Dorfman Dory Douady Doussa Dovesi Drago Draxler Dreismann Dreizler Drendel Dressler Drushlyak Dubey Dubrovnik Duch Duchamp Ducla Dudley Dufty Dugay Duijnen Duijneveldt Duli Dunne Dunning Duong Duprez Dupuis Duque Durand Durani Durant Dutta Dyadyusha Dykstra Dynamique Dzia E EAE EAF EAG EAI EAS EBS EC ECA ECB ECC ECCa ECCb ECD ECE ECF ECG ECH ECL ECM ECP ECR ECS ECW ECa ECb ECc ECd EDC EDD EDE EDH EDM EDN EDS EDU EDW EEA EEC EED EEE EEF EEH EEI EEM EEN EEO EER EES EFE EFH EFL EFO EFS EFV EGE EGL EGM EGN EGR EGS EHC EHE EHF EHI EHL EHM EHMO EHP EHT EIA EIC EIE EII EIM EIO EIQ EIS EKT ELA ELC ELN ELP ELPa ELPb ELSEVIER EMC EME EMF EMH EMI EMM EMN EMP EMR EMS EMV EN ENA ENF ENG ENM ENS EOA EOE EOM EP EPC EPE EPI EPL EPM EPP EPS EPT EPV ERG ERH ESA ESB ESC ESCA ESD ESE ESF ESG ESH ESI ESL ESM ESN ESO ESP ESQ ESR ESS EST ESV ESZ ETB ETE ETM ETO ETP ETR ETS ETT EVB EVC EVD EVR EWF EWMO EWT EXGEM Eades Eaker Earle Easa Eberhardt Ebersole Echenique Eckart Eckhard Eco Ede Edgecombe Eduardo Egede Eggarter Eggleston Egon Eigenfunctions Eigenlevel Eiichi Eiko Eisaku Eisenstein Eittah El ElKhatib Elabsy Elander Elbert Electrochemistry Electronegativity Electrophysiology Elert Elgersma Ellenbogen Ellinger Elsevier Elvio Emch Emil Emilio Emin Emmons Enany Enchev Eneida Enflo Engdahl Engelking Engelmann Engels Enoki Enrique Entropic Enz Equilbrium Erakleion Erdos Eriksson Erkki Erland Ermler Escherichia Esper Esquivel Ess Essean Essen Esser Est Etchebest Etemadi Etters Eugen Evangelisti Evert Ewa Excimer Exciton Eyler Eyring F FAC FAI FAM FAX FBS FCA FCD FCE FCF FCI FCN FCP FCQ FDC FDD FDG FDN FDR FEC FEM FES FFC FGE FH FHE FHK FHS FIA FIC FIP FLM FMM FNS FOC FOD FOI FOOF FOTOS FPC FPF FPT FQM FRB FRP FRR FRT FSA FSB FSE FSG FSGO FSH FST FTAa FTAb FTC FUG FYP Fabbri Fabi Fabian Facell Facelli Facult Faddeev Fak Fantucci Farazdel Fatyga Faxen Fazzio Fe FeCO Federico Fedyanin Feenberg Feinberg Feiner Feng Fer Fernandez Fernndez Ferrara Ferraro Ferraz Ferreira FerreiraDaSilva Ferrell Feynman Ficocelli Fieck Fim Findley Finkel Fiona Flad Flannery Flisz Fliszar Flores Florian Fock Foley Folland Folsom Fonseca Foo Fornili Forssman Fortunelli Fournier Foyt Fr Fractal Fraczak Fraga Francesco Francine Franck Fraschio Fratev Frauenfelder Frecer Frederik Fredrik Freeon Freidman Frenkel Freund Fricke Fride Fridh Friedel Friedrich Fripiat Frisch Frishberg Fritsche Frobenius Froelich Frohlich Froman Frurip Fu Fuentealba Fugler Fuhrhop Fujikawa Fujimura Fujita Fukashi Fukuda Fukui Fukutome Fulscher Fulvia Fumihiko Fumio Funada Furois Fusco Fuster Futrell G GAA GABA GAC GAE GAGP GAT GBD GCA GCB GCC GCT GDD GDE GDI GDM GEC GED GEH GFA GFG GFM GFP GFQ GGB GGC GHA GHF GHO GHS GHW GKH GKS GLG GLT GME GNM GNV GOO GOS GOU GPA GPP GPT GPU GRM GRV GSE GSG GSP GSQ GSS GTA GTC GTE GTF GTM GTO GTS GUG GVB GVC GVM GVR GVS GWF GWP GZE Ga GaAs GaSb Gabbay Gabriele Gadea Gadre Galina Galv Ganas Gao Garbato Garc Garestier Garmer Garritz Gascoyne Gaspar Gaston Gatica Gatti Gaurishanker Gaussians Gayoso Gazdy Gazquez Ge Geerd Geertsen Gegenbauer Gel'fand Gelboin Geldart Gell Geller Geminal Genevi Geometrie Georg Georgiev Georgina Gerardo Gerhards Gerjesh Gerloch Gert Gh Ghio Ghodsian Gholomabbas Ghose Ghosh Gian Giancarlo Giansanti Gianturco Giessner Gilda Gilmore Gilson Gingerich Giorgina Giorgio Girard Girardeau Giribet Girjesh Gita Giuliano Giuseppe Glaucia Glucocorticoids Gochev Goddard Godinho Goetschel Golab Goldstein Goldstone Golebiewski Golelbiewski Golovko Gombar Gomes Gomez Gondo Gongora Gonz Gonzaalez Gonzalez Goodfellow Gopal Gorbach Gordan Gorinchoy Gortel Goscinski Gottfried Gould Goursot Goutam Gouterman Govil Goycoolea Gr Grabowski Graf Graffi Graovac Grassi Grassmann Gratarola Gratton Graw Grazyna Gready Green's Gregori Grein Grelland Grenet Gresh Grezegorz Grigolini Grigoras Grinberg Grishin Gritli Gritsenko Groenedael Groenendael Grossman Grotendorst Grudzi Grudzinski Grzegorz Gu Guan Guang Guangju Guanine Gubanov Guberman Gudrun Guenzburger Guha Guimar Guimaraes Gukovskaya Gukovsky Guldberg Gumbinger Gund Guner Gunnar Guo Guosen Guozhen Gupta Guriev Gurnani Guschlbauer Guseinov Gusenkova Gustav Gustavo Gutmann Gutowski Gutsev Gy Gyemant Gynther Gyorgyi Gyourgyi H HAB HAE HAEa HAEb HAEc HAFEZ HAH HAWa HAWb HBC HBG HBP HBV HC HCC HCD HCI HCM HCN HCOOH HCR HCS HCl HD HDMN HDO HDS HEB HEC HEE HF HFC HFD HFE HFG HFH HGB HGG HHE HIN HIR HKT HLA HLB HLi HMT HMX HNO HNR HNSi HOM HORWOOD HPC HPP HPS HRB HRP HS HSA HSE HSF HSM HSO HSS HST HT HTC HTL HTO HTS HTTP Haberland Habitz Hada Hae Hafez Hai Hajime Halogenated Halpern Halpin Halsted Hamano Hamdi Hamed Hameka Hamiltonians Han Hanno Hansch Hansen Hao Haque Harcourt Harel Hariharan Harmalkar Harrell HarrellIi Harriman Hars Harsanyi Hartikka Hartmann Hartree Haruo Hasbrouck Hashimoto Havlas Hayashi Hayns HeH Heaton Hecht Heeger Heffernan Hefti Hegarty Hehenberger Hehre Heiberg Heidrich Heinricher Heinzwerner Helgaker Hellmann Hellsing Helmy Hendekovi Hendrik Hengyi Hennico Henri Henrik Henriksson Henryk Hermann Hermitean Hermitian Hermsmeier Hern Hernandez Herndon Herzig Hevesi HgTe Hiberty Hickman Hidalgo Hidekazu Hideo Higgins Hijmans Hilal Hillenbrand Hiller Hinchliffe Hingerty Hinze Hirakawa Hirao Hiraoka Hirata Hirayama Hiroaki Hirohiko Hiroike Hirokawa Hiroki Hiroshi Hirota Hiroyasu Hiroyuki Hirschfelder Hisaharu Hiskes Hite Hjalmars Hjalmarson Hobza Hochmann Hodgkin Hodo Hoffmann Hofmann Hohenberg Hohlneicher Hoinkis Holas Holleboom Holme Holmgren Holmstr Holzwarth Homotetrahedryl Hoor Hopfinger Hopkinson Horacio Hori Horst Horwitz Horwood Hoshino Hosokawa Hosoya Hosson Hosur Hotokka Hout Howery Hron Hsu Hu Hua Huai Huang Huba Hubac Hubbard Huber Hui Huillier Hund Huntington Hurley Husimi Hussein Hutchens Huzinaga Hvidt Hybertsen Hydrogenic Hydrophile Hydroxydimethylnitrosamine Hylleraas Hynes Hyperpolarizability Hyperviral Hypervirial Hypevirial Hywel I'haya IAA IAC IAE IAH IAN IBA IBN IBP IBS IBT IC ICB ICBa ICBb ICD ICF ICG ICH ICL ICM ICO ICP ICQ ICQC ICR ICS ICT IDA IDB IDC IDE IDN IDO IDP IDT IEA IEC IEE IEI IES IET IFC IFT IFV IGF IGLO IGV IHB IHC IHF IHM IHO IHP IHR IIA IID IIE IIP IIR IIS IJQC IJQCB IJU ILB ILC ILE ILM ILP ILT IMA IMB IMC IMCa IMCb IME IMF IMH IMI IMM IMN IMO IMQ IMS IMT IMV INDO INITIO IP IPB IPC IPD IPE IPF IPI IPM IPP IPPP IPQ IPT IQM IR IRC IREa IREb ISA ISBN ISC ISD ISE ISF ISH ISI ISM ISN ISNa ISNb ISO ISP ISR ISS ISSN ITA ITE ITF ITH ITI ITL ITM ITO IUH IUM IUPAC IVB IVS IWS IWY IZM Ia Iachello Iadonisi Ian Ib Ibantez Ibha Icheva Ichi Ichikawa Iffert Igawa Igel Ignacio Igor Ihaya Iijima Ikuta Il Il'Icheva IlIcheva Ilya ImH Imamura Iminosilicon Immanant Imre Ing Inga Ingemar Ingolfsson Ingrid Initio Inokuti Inoue Int Interatomic Intercalative Internet Interscience Intershell Intersubband Invertibility Ionophores Ioriatti Iraklion Irgibaeva Irreversibility Isaiah Ischenko Ishida Ishiguro Ishikawa Isihara Iskander Isom Isomeric Isomerizations Isoscalar Isospin Isoxazolol Issa Istv Itagaki Ivailo Ivanov Ivar Iwai Iwaki Iwata Iyakutti Iyer J JHV JMS JUN JWKB Jacchieri Jacek Jackiw Jacopo Jaeju Jaffe Jaggard Jahn Jai Jaime Jain Jaiswal Janardan Jankowski Janmkowski Janos Janssen Janusz Jarlskog Jasien Jasna Jasselette Jaworski Jayaram Jayaraman Jayasuriya Jeanne Jena Jens Jensen Jeppe Jeri Jeria Jerker Jerman Jerzy Jespersen Jesudason Jeziorek Jeziorska Jeziorski Jhon Ji Jian Jiang Jianmin Jiaxi Jiin Jikang Jin Jing Jingqing Jiri Jo Joachim Johan Jonsson Jorg Jorgensen Jortner Jos Josep Joshipura Josiane Josip Joze Jozef Ju Judd Juergen Juha Jukka Jul Julg Jun Junard Juraj K KCT KDT KEF KEP KET KLUWER KOBEISSI KRIEGER KTB KVP KVV Kagawa Kahn Kai Kaijser Kaiser Kakuta Kalcher Kaldor Kalenov Kalia Kaliannan Kaliszan Kalos Kalyan Kamal Kamalni Kaminski Kampen Kanda Kania Kaniauskas Kanivets Kannan Kantzer Kaoru Kapoor Kapuy Karabunarliev Karadakov Karafiloglou Karelson Kari Karle Karlheinz Karlsson Karlstr Karmowski Karna Karo Karpfen Karsten Karunakaran Karwowski Kashiwagi Kaspar Kat Katagiri Kataoka Kato Katovi Katrib Katriel Katritzky Katsufumi Katsuhiko Katsuki Kattija Kauder Kaufman Kaur Kazansky Kazuhiro Kazuo Kazuyoshi Keegstra Keerthi Keiji Keiko Kekul Kell Kello Kelm Kemister Kenichi Kenji Kenny Kenzi Kern Kert Kerteasz Kertesz Kestner Ket Ketkar Keto Khait Kharkyanen Khatib Khetrapal Khuri Kiang Kibler Kichisuke Kieber Kier Kierdaszuk Kikuchi Kilzer Kimihiko Kimiko Kimio Kimura Kinoshita Kirkjian Kirtman Kister Kitagawa Kiyoshi Kizashi Kizhner Klasinc Klei Kleiner Klessinger Klimko Klimo Klobukowski Kluge Kluwer Knappe Knop Ko Kobashi Kobayashi Kobeissi Kobus Kochanski Kocjan Koda Koelling Koga Kohda Kohji Kohler Kohli Kohn Kohonen Koichi Koichiro Koizumi Kojima Koller Kolli Kollman Koloman Kolos Komiyama Komninos Komornicki Konaka Kondow Kono Kononenko Konschin Koo Koon Koopman Koopmans Korb Korchowiec Korek Kos Koski Kotani Kotarov Kothekar Kotwal Kotzev Kouri Kouteck Koutecky Kov Kova Kovacevic Kovarskii Koyama Koz Kozlowski Kozmutza Kozo Kr Kramers Krasnogolovets Krauss Kre Krebs Krechl Kresin Kreuzer Krieger Krishan Krishnan Krivka Krogh Kruglyak Kruglyakova Kryachko Krylstedt Krystyna Krzysztof Ku Kubo Kubota Kucar Kucharski Kuchitsu Kuhnen Kuivalainen Kukhar Kulkarni Kumar Kumazawa Kumi Kumicaak Kumicak Kummel Kuntz Kunz Kurnig Kuroda Kuropteva Kurtz Kuruoglu Kushick Kusmierek Kuthan Kutzelnigg Kutzler Kvasni Kvasnicka Kventsel Kwiatkowski Kyu L L'Huillier LAA LAMMA LAS LAU LBG LBH LBK LBM LBP LBR LBS LBW LCA LCAO LCAS LCB LCCN LCGTO LD LDE LDF LDO LDP LDS LDT LE LEA LEC LEI LEL LEM LGA LGU LHG LHuillier LIF LIW LL LLC LME LMM LMO LMR LMS LMT LMU LO LOC LOL LOS LP LPL LPP LPa LPb LR LRC LRE LRI LRS LSC LSD LSF LSN LSRa LSRb LST LSX LUMO LVS LXA LXC LaFemina LaTeX Laaksonen Labbe Lactam Ladik Ladikm Lafemina Lafont Laforgue Lafourcade Lagos Laguna Lahiry Lai Laidig Laidlaw Laitinen Laki Lala Lalit Lam Lamanna Lambin Lamm Lan Lanczos Landman Landsberg Lang Langevin Langhoff Langlet Lapiccirella Largo Larhee Larsson Laskowski Laszlo Latajka Lathouwers Lauer Lauher Laurenzi Laux Lavery Lawes Lawley Lazzeretti Le Lea Lebreton Lefebvre Lehrbuch Leibina Leif Leite Lek Leland Lelj Lemaistre Lemin Lenaz Lengsfield Lennart Lentei Leontyev Les Lesyng Leszczy Leszczynski Leszek Leu Leubner Leuven Levente Levitan Levitt Lewchenko Ley Leyda Li LiBH LiBeH LiCH LiH Liang Liangyou Liaofu Liberato LiberatoDeBrito Liberman Libero Liboff Lieb Liehr Lim Lin Lindblad Linder Linderberg Lindgren Lindh Lindholm Lindner Ling Linnett Lino Liouvillians Lipi Lipinski Lipkin Lipkowitz Lippert Lippmann Lipscomb Lischka Littleton Litto Liu Livjeet Lizardo Ll Llanos Lled Lledos Lloren Lluch Lobatch Lochmann Loew Lohr Longuet LopezDeCompadre Lorenzo Lothar Louie Lowdin Lowe Lowrey Lozes Lu Lua Luan Luana Luc Lucchese Luci Lucjan Lude Ludena Ludenta Ludwik Lue Luger Luigi Luis Luisa Luiz Lukashev Luken Lukovits Lumbroso Lun Lundqvist Lundstr Lundstrom Lunell Lunjiang Luo Lupo Luz Luzanov Lyapunov M MAH MAI MAL MAQ MAV MB MBC MBD MBE MBFa MBFb MBI MBL MBP MBPT MBR MBS MC MCB MCC MCD MCE MCF MCGRAW MCI MCL MCM MCN MCO MCR MCRPA MCS MCSCF MCT MCTDHF MDB MDC MDH MDI MDR MDS MDT MEA MEB MEC MEE MEF MEM MEP MES MESFET MFH MGB MGI MGO MGV MHE MHF MHS MIA MIB MIC MIM MINDO MIP MIS MLC MLF MLM MLS MLSa MLSb MMB MMC MME MMH MMM MMO MMP MMS MNDO MNM MO MOC MODPOT MOI MOM MOS MOT MP MPA MPF MPG MPI MPM MPP MPQ MPR MPS MPT MPV MPX MQE MQS MRA MRC MRCI MRCa MRCb MRD MRQ MRT MSA MSB MSC MSD MSE MSF MSI MSM MSN MSO MSP MSR MST MSU MSW MSX MTA MTBa MTBb MTC MTD MTM MUC MVC MVO MWO MXA MXM MXT Maartensson Maayani MacElroy Macdiarmid Macias Maciej Maclagan Maclaurin Madhab Maekawa Maffeo Magdalena Maggiora Magnoli Magnus Mahajan Maher Mahesh Mahmoud Maitrot Majumdar Makhyoun Maki Makoto Maksi Maksic Malathi Malcom Malgorzata Malinowski Malmqvist Malrieu Maluendes Maluszynska Malykhanov Manas Manca Mancini Mangoni Manju Manjubala Manmoto Mann Manne Mano Manoel Manoj Manson Mantsivoda Manuel Maouche Mara Maranon Marc Marcello Marcelo Marchenko Marchese Marchetti Marck Marco Marconi Mareca Marek Margareta Margarida Mari Marian Mariano Maric Marigliano Marinangeli Marinaro Marineland Marini Mariusz Maroulis Marquardt Martensson Martins Martyn Maruani Maruszewski Maruyama Masahiko Masahiro Masamichi Masao Masaru Masashi Masataka Masato Masayoshi Masayuki Maslen Massa Massimo Masson Masthead Mata Matcha Matesh Mathers Mati Matos Matric Matscheko Matsen Matsumoto Matsuno Matsuo Matsuoka Matsushita Matthias Matti Mauricio Mayevsky Maynau Mazo Mazurek Mb Mc McCreary McCullough McDiarmid McDowell McGlynn McIsaac McKoy McMahan McWeeny Mccarroll Mccaskill Mcdonald Mcdowell Mcglynn Mckeen Mckoy Mclaughlin Mcnutt Md MeV Mechanik Medesan Medina Meena Meghezzi Mehler Mehlhorn Mehrotra Mehta Meishan Meissner Mekenyan Mele Melin Mello Melo Mendel Mendenhall Mengual Menlo Mensching Mercouris Mermin Meshitsuka Mestechkin Meta Metin Meyreddy Mezei Mezey Mf Mg Mh Mi Mia Micha Michal Michalska Michel Michels Michl Microfiche Middlebrook Mielczarek Miertu Miertus Migdalek Mihir Mikael Mikio Mikkelsen Mikl Miklos Mildvan Milica Millen Milli Min Minaev Minato Mineo Ming Minoru Mintmire Mireille Miret Miroslav Misako Mise Mishra Misiak Misurkin Mitani Mitio Mitra Mitsuo Miu Miwa Miyoshi Mizutani Mj Mk Ml Mladenov Mm Mn MnCl Mo Modrak Moffat Mohallem Mohamad Mohammad Moiseyev Mojm Mola Moldoveanu Mollmann Mon Mondrag Mondragon Monkhorst Mononitro Monte Montella Montenay Mookerjee Morelli Morita Morley Morokuma Morozov Moscard Moscardo Moskovskaya Moskowitz Mota Mott Mouchet Mounzer Mouritsen Moustafa Moyano Mrigank Mrozek Mu Muckerman Mujica Mukerjee Mukesh Mukherjea Mukherjee Mukhopadhyay Mukti Mula Mulchandani Muldahmetov Mulder Mulliken Multibody Multiconfiguration Multiconfigurational Multimode Multiphoton Multipole Multistep Munetaka Munn Muramatsu Murdoch Murgich Murilo Murrell Murthy Murty Mushketik Mustaq Muszy Muszynska Muttaiya Myer Myung N NA NAA NAC NAD NAF NAH NAQ NAS NAU NCB NCC NCD NCE NCF NCH NCM NCT NDC NDE NDI NDM NDO NDP NDS NDT NDW NEC NEF NEM NEN NEO NES NFD NFG NGA NGC NGTa NGTb NGTc NH NHE NHF NHFB NHG NHO NHOH NHR NIDDM NIF NIG NIM NIW NJ NKF NKM NLC NMAa NMAb NMC NMD NMH NMO NMP NMR NMT NMV NNA NNE NOC NOE NOF NOL NP NPF NPI NPS NRP NRS NS NSA NSC NSE NSG NSH NSI NSM NSP NSS NST NTD NTI NWF NY Na NaCl Naaray Naba Nadia Nagakura Nagamura Nagaoka Nagarathna Nagashima Nagata Nagel Naghizadeh Nagy Naik Nakada Nakajima Nakamura Nakano Nakashima Nakatsuji Nakaya Nalewajski Namboodiri Namur Nanny Naoto Naray Narayan Narita Nascimento Nath Natiello Natielo Nato Nauman NbC Ne Neckel Negadi Neil Nelin Nemukhin Nenad Nesbet Neshev Neshey Neto Nettleton Neumann Nevalainen Newns Nguyen Ni NiCO Nicola Nicolaides Niesar Niessen Nieuwpoort Nieves Nigel Nigm Nikam Nikoli Nikolovski Nilar Nils Nimrod Ning Nino Nirad Nishimoto Nitish Nitrocubanes Nitroexplosives Nitromethane Nitya Niu Niukkanen Noack Noat Nobuhiro Nodeless Noell Nogueira Noguera Nohad Nomura Nonadditive Nonadditivity Nonadiabatic Nonalternate Nonbonded Noncovalent Nonempirical Nonenzymatic Nonlocal Nonorthogonal Nonrigidity Nonsinglet Nonvanishing Noor Norby Norcross Nordlander Noriyuki Noro Norwell Nos Novak Novaro Novosadov Novoselsky Nowak Nudelman Nyden Nylander O O'leary O'neal OA OAS OBC OC OCDa OCDb OCE OCS OD OEA OEE OEP OFA OFL OFTa OFTb OGC OHE OHR OIA OIK OIM OKS OME OMS OOS OP OPA OPB OPD OPE OPL OPP OPS ORG ORT OSA OSC OSF OSH OSO OSP OSR OSW OTE OTM OTP OTS OWH Obara Obcemea Obis Oct Oddershede Odiot Odom Ogawa Ogilvie Ohanessian Ohno Ohrn Ohtsuki Oie Oikawa Ojha Okido Okio Oktay Oladipo Olbrich Oldfield Ole Oliva Oliveira Olle Olof Olov Olovsson Olsson Olszewski Olthoff Ondrechen Oneal Oran Orbitals Organizer's Oriade Oriano Orientational Orsay Orthogonalization Orthonormalization Ortiz Ortolani Orville Osamu Osamura Osanai Osapay Osika Osman Osorio Osvaldo Ottenbrite Ouamerali Ourida Ov Ovchinnikov Oxo Ozaki Ozkan Ozment P PAA PAC PAF PAU PBG PBI PBL PBM PBT PCA PCC PCE PCF PCG PCH PCI PCILO PCM PCO PCP PCS PCT PDA PDM PDP PDR PDS PEC PED PEM PES PEU PFD PFI PFO PGA PGC PGF PGO PGS PH PHARM PHG PHS PIA PIF PIM PIS PIV PIW PLO PMC PMK PMP PMR PMT PN PNA PNB PNM PNS PNU PO POC PON POS PPA PPB PPI PPL PPM PPO PPP PPR PPS PPT PQC PRL PRP PRR PRS PRT PRW PSA PSB PSC PSE PSG PSH PSQ PSR PSS PST PSU PTB PTC PTD PTE PTH PTI PTL PTM PTO PTP PTR PTS PTT PTW PUU PVD PVS PWA PWI Pacios Padeleimon Padial Padilla Padjen Padkj Padkjer Pakiari Pakkanen Paldus Palke Palla Palma Palmieri Pamidimukkala Pande Panerai Paniagua Panin Paolillo Paolo Papierowska Pappalardo Paquet Parada Parametrization Pardo Parenti Parr Parra Particlelike Pasquale Pastewski Pastore Patnaik Paton Patricio Patrik Pattabhi Pattnaik Pau Pauling Paulo Pauncz Pausescu Pav Pavato Pavel Pavlenko Pavlides Pavlovi Pavlovic Pawel Pazhenchevsky Pb PbTe Pd PdCl Pe Pechenaya Pedash Peder Pedersen Pedrini Peierls Peinel Pekka Pelik Pelissier Pellegatti Pendrill Penigault Percus Perdew Permutational Pernot Perondi Perrin Persico Persson Pertosa Perturbational Perturbative Pesando Peshev Petelenz Petersson Pethig Petke Petkov Petr Petrella Petrongolo Petrov Petsalakis Pettersson Pettitt Peyerimhoff Peyrard Ph Phadke Phariseau Pharmacodynamics Philippa Phillip Phonons Photobiology Photochemistry Photoelectron Photoionization Photoreactions Physicochemical Physikalische Piacentini Piazzola Piccitto Pickett Picone Picosecond Piecuch Piela Piercarlo Pieter Pilar Pilarski Pincus Piotr Pipek Pipin Pireaux Piron Pisani Pitzer Plathe Plesset Pluta Pohl Pohorille Poirier Pokleba Polansky Polezzo Polg Politzer Polivtsev Poltev Poly Polyaminopolynitrobenzenes Polyatomic Polymeropoulos Polymers Pong Popkie Pople Popov Popova Popovi Porath Poshusta Postnikov Poul Poulain Poulsen Pradeep Prakash Pranawa Praphull Prasad PrasadBhattacharyya Prasanta Prat Pratibha Pratip Pre Preben Preiskorn Pren Prettre Preuss Preziosi Prieto Prigogine Prithvi Priyadarshy Priyotosh Prohofsky Proinov Propagator Propin Protometabolism Protonation Protsenko Przybylski Pseudodegenerate Pseudopotential Psoda Pt PtCl Pucci Pudzianowski Pueyo Pulatova Pulay Purdela Purine Purvis Purvism Pyykk Pyykko Q QAF QAS QC QCC QCD QCI QCL QCLDB QCLa QCLb QCLc QCM QCQ QCS QCSa QCSb QCV QD QDH QDM QDW QEA QFD QFT QH QIO QLH QLP QM QMC QME QMI QMM QMS QMT QMW QOD QP QPS QQC QSA QSAR QSARs QSE QSG QST QTC QTD QTH QTP QTS Qi Qian Qianer Qing Qiyan Quadrelli Quan Quantal Quantenchemie Quantenphysik Quasidegenerate Quasifree Quasirelativistic Quaternions Quelques Quesnoit Qui Quijada Quiney R RAA RAE RAS RBC RBE RBEa RBEb RBH RBP RBS RBT RC RCC RCD RCE RCG RCI RCO RCR RCS RCV RDC RDD RDE RDM RDO RDP RDR RDV RDX REA REB REE REH REIDEL REL REM REP RES RF RFC RFE RHA RHF RI RIE RIF RKR RLE RLP RM RMA RMC RME RML RMP RNA ROC RPA RPAC RPD RPE RPF RPG RPQ RPR RPT RPU RQD RRC RRE RRH RS RSA RSC RSG RSH RSI RSO RSP RSPT RSPa RSPb RSS RTA RTB RTE RTM RTO RTP RTQ RUA RWT Raatz Rabi Rabii Rabinowitz Racah Radhakrishnan Radiobiology Radioprotector Radom Radzio Rae Raffaele Rafie Raghavachari Raghunathan Raimondi Raina Raj Rajabali Rajeev Rajendra Ralf Ramaglia Ramakrishna Raman Ramanadham Ramani Ramasesha Ramaswamy Ramiarez Ramirez Ramon Ramos Randez Randi Randic Randica Ranganathan Ranghino Ransil Rao Rashin Rasolt Ratajczak Ratna Ratner Ravech Raveche Ravenek Ravi Ravichandran Ravindra Ravishanker Rawlings Razavy Recami Recamier Redfern Reggio Regier Reid Reidel Reidle Reif Reinaldo Reinhardt Reinhart Reinhoudt Remmers Ren Renato Renormalized Rentzepis Renzo Requena Rerat Rescigno Resta Rettrup Revetllat Ria Ribberfors Ricard Ricardo Ricatti Rico Riera Rifaat Rijdt Riklund Risto Ritchie Rittby Rivas Rivera Riveros Rives Robb Rodero Rodolfo Rodr Rodwell Roeggen Roetti Rohmer Rojas Rolf Romanowski Romelt Ronaldo Roncero Rong Rongshun Roos Roothaan Ros Rosa Rosanna Rosato Rosch Rossi Rossikhin Roszak Rothstein Rotthier Roustan Rouvinen Rouvray Roychoudhury Royer Royyuru Rozeanne Ru Ruben Rubik Rubin Rudolf Rudzikas Ruedenberg Ruelle Ruette Ruifeng Ruiyu Ruiz RuizDeAzua Rumer Ruo Ruozhuang Russo Rusu Ruttink Ryaboy Rydberg Ryogo Ryszard S SA SAA SAB SAC SAE SAH SAI SAMO SAQ SAR SAS SBA SBD SBH SBS SCA SCAa SCAb SCC SCD SCE SCF SCG SCH SCI SCM SCP SCQ SCR SCS SCT SCU SDA SDC SDD SDF SDG SDL SDM SDO SDP SDQ SDR SDS SDT SDU SE SEC SEM SEP SES SF SFA SFB SFC SFE SFF SFP SFQ SFQa SFQb SFQc SFS SGA SGC SGG SGS SHC SHO SIA SIB SIBFA SID SII SIM SINDO SITa SITb SLE SLP SMC SMD SME SMF SMI SML SMM SMN SMO SMP SMR SMS SNA SNC SNE SNI SNM SNR SOC SOE SOG SOM SOO SP SPA SPB SPC SPE SPF SPFa SPFb SPG SPH SPL SPN SPO SPQ SPR SPS SPT SQA SQC SQE SQR SQS SR SRA SRC SRD SRE SRF SRH SRM SRP SRR SRS SRT SRU SS SSB SSC SSD SSDa SSDb SSE SSF SSI SSM SSN SSP SSR SSS SST SSU STC STD STI STM STO STOS STOs STP STR STS STT SUO SV SVD SVE SVS SVT SW SWD SWF Saalfrank Saavedra Sabin Sabio Sablji Sabljic Saburo Sachs Sadao Sadlej Safronova Sagar Saika Saito Sakai Sakamoto Salahub Salaneck Salin Salsa Salvetti Sambhu San Sandbjerg Sanderson Sandl Sandorfy Sandoval Sandro Sangfelt Sanibel Sankar Sankey Sannigrahi Santamar Santamaria Santhanam Santoro Santos Sanyal Sanz Sapse Sarai Saran Saraswathi Sargautis Sarma Sarojini Sartorelli Sasaki Sato Satoh Satoshi Saturno Satya Satyam Sauer Saul Savatinova Savin Sawaryn Saxe Saxena Sayed Sbarbati Sbrana Sc Scanlan Schaad Schaefer Schaeffer Scharf Scharfenberg Schatz Scheiner Scheire Schiff Schippnick Schl Schlegel Schlesinger Schluter Schmalz Schmelzer Schmidtke Schnur Scholz Schopov Schr Schuch Schulman Schur Schuster Schwarz Schweitz Schwenke Schwerdtfeger Schwinger Scolfaro Scribner Scrocco Scuseria Seel Seelig Segedy Seger Segre Seibert Seiders Seiji Seijo Seitz Sekharudu Sekiguchi Sekino Selmani Semiclassical Semidiffuse Semiempirical Semigroups Sen Senba Sengupta Sephali Serafin Serber Sergeevich Sergio Serine Serines Serna Serre Setser Setsuko Sewell Seybold Seydel Shahbaz Shambhu Shamov Shankar Sharma Sharpe Shavitt Sheina Shellwise Shen Sheng Shepard Sheppard Sherif Shestopalova Shi Shibani Shibata Shibuya Shigehiro Shigeru Shigetaka Shih Shik Shiliang Shillady Shimizu Shinagawa Shinichi Shipsey Shiro Shivaglal Shoba Shobha Shockley Shoda Shoji Shoon Shridhar Shu Shubnikov Shugar Shuichi Shukla Shulgin Shull Shunsuke Shusterman Shyi Si SiF SiS Sibert Sid Siddall Sidebotham Siebrand Siedentop Siegbahn Siegert Sierraalta Sigeru Sigrid Silbey Silina Silva Silvano Silverman Silverstone Silvi Sim Simas Simone Simonetta Simoni Simonis Simons Sinano Sinanoglu Singh Singhal Sinha Sinkkonen Siqueira Siqueria Sj Sjogren Sjostrand Sk Skala Skancke Slanina Sleta Smedarchina Smentek Smet Smeyers Smotryaeva Sneddon Snijders Soares Sobolev Socolar Sohrab Sokalski Soko Solavation Soliton Solitons Solitony Solmajer Solnyshkina Solovay's Solvation Sommer Sonawat Soni Sonja Sonnad Soos Sordo Sorensen Sosa Spanget Spangler Spiga Spingarn Spinors Sr Srinivasan Srivastava Staemmler Stafstr Stafstrom Stamato Stanislav Stanislaw Starodub Staszewska Statistische Steckler Stedman Steef Stefano Steinborn Sten Stepanov Stereochemistry Stereoelectronic Steric Stieltjes Stig Stillinger Stodden Stoitsov Stolarczyk Stoll Stranges Stroyer Stubb Sturmian Sturmians Styszy Su Suard Subba Subhash Subhashini Subhendu Subra Subsymposium Sucher Sucre Sudha Sudhindra Sudipto Sudoh Suga Suh Suhai Suitability Suk Sukant Sukhorukov Suman Sundaralingam Sundaram Sundholm Sunil Supercomputing Superoperator Superoperators Superoxide Supersecondary Suqian Sur Surj Surjan Surjit Sury Susil Sutcliffe Svante Sven Svendsen Svensson Sverdlov Svr Svrcek Swaminathan Swanstr Swenson Sykja Sylvette Sylvie Sylvio Symmetrization Symons Symposia Syposium Syren Szab SzabO Szabo Szaboa Szalay Szalewicz Szasz Szcz Szcze Szczepan Szczepaniak Szczesniak Szent Szentp Szpunar Szymanski T TAA TAC TAD TAE TAI TAK TAQ TAS TATB TBN TBO TBP TC TCB TCC TCE TCF TCH TCM TCNE TCNQ TCP TCR TCV TDB TDD TDDa TDDb TDDc TDF TDFa TDFb TDH TDHF TDN TDO TDS TDT TDV TDW TDX TEH TEM TER TES TEV TEX TFA TFN TFT TFY TGP TGS THB THC THG TIA TICa TICb TID TIDa TIDb TIEa TIEb TIF TIH TII TIR TIS TKA TKT TLE TLS TMD TME TMM TMP TMS TMT TNI TOQ TOX TPC TPD TPE TPP TPS TPT TQE TQEa TQEb TRF TRP TSA TSC TSD TSE TSG TSH TSI TSL TSM TSN TSO TSP TSR TSS TST TTF TUC TUE TUI TVS TVT Tabor Tachibana Tadashi Tadayoshi Tadeusz Tai Taijin Takada Takahashi Takahata Takakazu Takamiya Takao Takashi Takayanagi Takayuki Takeshi Taketa Takeuchi Taki Taku Takuma Tal Talbi Talekar Tam Tamara Tamassy Tamm Tamotsu Tanaka Tancredi Tani Tanimoto Tantardini Tapani Tapia Tarr Tatake Tatar Tatewaki Tatum Taurian Tautomerism Tavard Te Teikichi Teitell Tejerina Tel Tellinghuisen Temussi TenHoor Teplukhin Terada Terasaka Tetrathiafulvalene Tetsuro Teuvo Tewari Th Thakkar Thakur Thalidomide Thallam Theochem Theodorakopoulos Theophanides Theoretische Thiagarajan Thierry Thilagam Thiophilic Thirring Thirumalai Thirunamachandran Thiry Thole Thom Thozet Thulstrup Thuraisingham Ti TiBe TiC TiN TiO Tian Tibor Tidjani Tieh Tillieu Timoneda Tina Tindimubona Ting Tinland Tiong Titchmarsh Tlepbergenov Tobin Togasi Tohru Tokio Tokura Toli Tolman Tomas Tomasek Tomasello Tomasi Tomchuk Tometsko Tomislav Tomoko Topiol Toro Toshiharu Toshihiko Toshikatsu Toshikazu Toshimasa Toshitaka Tossell Tostes Toyama Toyoda Trachtman Trapane Trautwein Trevor Tri Trickey Trinajsti Trinajstic Tripathi Tripathy Trivedi Trombetta Troxidone Trsic Truax Truhlar Trygve Ts Ts'o Tse Tsetlin Tsirekidze Tsuboi Tsuda Tsujikawa Tsukada Tsun Tsutomu Tsvankin Tue Tumanyan Turmo Tuszy Tuszynski Tvaro Tvaroska Tyagi Tylli Tyrrell Tyutyulkov U UAE UAL UALa UALb UCC UCQ UDG UDP UEC UEN UEP UGA UGAa UGAb UGAc UGB UGF UGT UHF UHS UIB UID UIN UIP UK ULE ULL ULLa ULLb ULT UMB UMP UMR UNO UPA UPC UQG UQGa UQGb UQM URL URW USG USO USR UT UTD UTE UTK UTM UTS UTT UTU UV UVP UVT UWI Uchida Uehara Uematsu Ugalde Ujino Ukrainskii Ulf Ulmer Umemoto Umpei Umrigar Unitarily Unsymmetrical Upendra Uppsala Uracil Urdaneta Urry Uyesaka Uzi V VAM VAS VBC VBDa VBDb VBM VBP VCC VCD VCE VCG VCI VCM VCP VCS VCV VDF VDS VDW VED VEE VERLAG VFA VFG VFH VFP VIO VIP VIS VIT VLI VLS VMA VMC VMV VNR VPC VPH VPO VPT VRDDO VRF VRL VRQ VRS VSE VSF VSH VSM VST VSU VT VTB VTG VWF VWM Vahe Vaida Valery Valli Valone Valtazanos Valtaznos VanCamp VanDoren VanGroenendael VanKampen VanZandt Vanderheyden Varandas Varga Variational Variationally Varma Varracchio Vasanth Vasantha Vasilenok Vasilescu Vasini Vassileva Vaughan Vedene Vekantchalam Vela Velde Venanzi Venediktov Venkatachalam Ventura Vercauteren Verevkin Verlag Verma Vermeulin Versluis Verwoerd Vesa Veseli Vessal Vestewig Viana Viani Vib Vibrational Vibrationally Vibronic Vicente Vigneron Vijay Vilallonga Villar Villarreal Villiam Vincenzo Vinette Vinszky Vipin Virial Vishveshwara Viste Vitkovskaya Vittorelli Vivier Vivil Vladim Vladimiro Vlasta Vleck Vogl Vogler Voigt Voitl Vojt Vojtik Volkmann Volkov Volkova Volosov Von VonBoehm Voronkov Vosman Vrbik Vrscay Vucetich W WA WCI WDK WDL WDP WHC WHD WIC WII WIM WIP WLA WLO WMI WPT WTM WWS WWW Waals Wacknow Wagstaff Wah Wahl Wald Waleh Wannier Wardlaw Wasilewski Wasserman Watanabe Weatherford Webb Wedler Wei Weidman Weigold Weinberger Weiner Weinhold Weinstein Weinstock Weintraub Weizs Weizsacker Weller Wen Wendin Weniger Wesenberg Westbrook Westgate Westhaus Westhof Weyl Weyrich Whiteside Whyman Widlund Wierzbicki Wieting Wietling Wigner Wijkman Wilde Wilfredo Wilhelmsson Wilkins Willem Willis Willson Winkler Wirsich Wiseman Witko Witschel Wlodzislaw Wo Wojcik Wold Wolfhard Wolford Wolfskill Wolniewicz Wong Woodworth Woolley WorldCat Wormer Wu Wurzburger X XII XIII XIV XLII XPS XPY XRI XVI XXII XXIII XXIV XXV XXXI XXXIII XXXIV Xe XeF Xian Xiangshan Xiangzhu Xiao Xiaoyu Xiaoyuan Xin Xiu Xiufan Xizhang Xu Xue Xuefeng Xuehe Xuejun Y YBa Ya Yadav Yaker Yakovlev Yakushevich Yala Yamabe Yamaguchi Yamanouch Yamanouchi Yamashita Yan Yanbo Yano Yaris Yarkony Yash Yasnikov Yasuhiko Yasuko Yasuyuki Yathindra Yi Yliniemel Yliniemela Yngve Yoneda Yonezawa Yong Yoon Yoram Yorihiko Yoshiaki Yoshihiro Yoshikawa Yoshiko Yoshinori Yoshitaka Yoshiya Yosuke Yousif Yu Yuan Yuji Yukawa Yun Yung Yuri Yuriko Yurtsever Yury Yusaf Yusei Yutze Z ZDO ZERNER ZN ZQO Zahradn Zahradnik Zaidi Zaitsevskii Zakrzewska Zanasi Zandt Zasukha Zaucer Zden Zdzis Ze Zeeman Zegar Zeiss Zeki Zelda Zelek Zemin Zeng Zerner Zernert Zeroes Zh Zhan Zhang Zhao Zheltovsky Zhen Zheng Zhengming Zhenyang Zhenyi Zhi Zhida Zhidomirov Zhixing Zhongxiang Zhou Zhu Zhuang Zichi Zidarov Zielinski Zintl Zivkovic Ziyong Zlatko Zn ZnS Zolt Zong Zonghao Zorita Zs Zu Zuhrt Zuloaga Zunger Zuniga Zvonimier Zvonimir Zyss ab abal abor abortifacient abortificient ac acetal acetamide acetonitrile acetyl acetylcholine achiral acidium ack acknowledgement acm adaption adatom adatoms adduct adenine adr adrenergic adrenoceptor adsorbates aflatoxin aflatoxins agarose ageing agonism agonist agonists agp aires ajournal ak al alaninate alanine alanylcarbonyl alez alg aliphatic alkane alkanes alkylated alkylating allene allomorphic alloying allyl alternance alternant amez amides amidogen amine amines aminoacyladenylate aminobutyric aminomethyl aminopyrone aminotetralins aminothiol amu analgesia analogue analogues andalusite andez andor anharmonic anharmonicity anhydrase anilino anilinonaphthalenesulfonate anisotropics anisotropies annuelles annulene anos anthracene anthracenes anthraquinone antibond anticancer anticholinesterases anticonvulsant antiepileptic antiferromagnet antiferromagnetically antiinflammatory antiparticle antipyretic antisymmetrized antitumor antitumour aperiodicity apez appliqu approximants apr aquo ar aray arene arez arnykh aromaticity ary aryl ascorbic asi aski aspartate asz aufbau aug autoassociation autoionization autoionizing aux auxins aw awik awomir aza azabiphenyls azef azines aziridine azobenzene b bacteriorhodopsin basicity beebe benz benzenes benzenoid benzo benzodiazepine benzodiazepines benzohydroxamic benzoic benzomorphan benzoquinone benzosemiquinone betacarboline betacarbolines bibdate bibmods bibnames bibsort bibsource bibsys bieta biewski bifluorenylidene bifurans bilayer binuclear bioanode biomolecular biomolecules biopolymer biopolymers bios biosciences biquadratic bis bisantrene bius bivariational booktitle bor boranes bosons bre brillouin bungarotoxin byyear c calmodulin camier canique carbanions carbene carbides carbolines carbonium carbonylheme carbonyls carboxylate carboxylic carboxymethyl carboxypeptidase carcinogenesis carcinogenicities carcinogenicity catacondensed catalase catalyzed cataractogenesis catdir catechol catecholamine cation cationic cations cephalosporin cet chelates chemisorbed chemisorption chemisorptive chemodynamics chemomechanical chiral chirality chiroptical chlorooxirane cholinergic chromophore chromophores chromosome chymotrypsin circulant cis ckel cker clupeine co codetable coenzyme coh coli collagenic collisional com complexed complexons compos configurational conformationally conjoncturelles conjugu constantes continua cooperativity copolymerizations cordycepin coset coumarin countercation counterion counterions covalency creatine cristal cs cubical culaire cyanides cyano cyanocarbonium cycloaddition cycloadditions cyclobutadiene cyclodextrin cyclodisiloxane cyclohexadiene cyclooctatetraene cyclopentadienyl cyclopentadienylidene cyclophosphamide cyclopropane cysteamine cysteine cytidyl cytochrome cytosine cytotoxic d d'hyperpolarisabilit d'hyperpolarisabilite d'ordre d'un dA dCpdG dT da dans das dc de deAndradaESilva deBruijn deaminase deazapurine dec deexcitation degeneracies degeneracy dehydrogenase delocalization delocalized dendritic deoxy deoxyadenosine deoxyfuranose deoxyuridines dependant dependences deperturbation dephasing der des deshielding determinantal detonations detoxification diabatic diacetamide diacridines diagonalization dialkylnitrosamines diallene diamino diaminodichloroplatinum diatomics dibenzo dibenzofurans dibenztetrathiofulvalen dichloro dichloroethylen dichlorooxirane dielectronic difluoroethylenes diger dihydrides dihydrofolate dilithioacetylene dimethyl dimethylamino dimethylaminoaniline dimethylaminobenzylidene dimethylbenz dinger dinitrobenzoyl dinucleoside dinucleotide diol dioxethane dioxins dipalmitoyl dipeptide dipeptides dipolar disaccharide disilene disilyne disubstituted dms docstring doi domaine dos dosSantos dover du duplexes dx e eV ecial ed edu egalement eggen eigenenergies eigenfunctions eigenstate eigenvectors eikonal ek elastin elastomeric elastomers electon electrochemical electrocyclic electrofusion electronegativities electronegativity electronique electrophilic electrotatic email enamines endoplasmic endorphins energetical enneagonaux enol entropic eorique epoxidations epoxide epoxides equilibria ergodography es espace est ester estrogens etats ethanolamine ethers ethylenes ethynyl eupeus eutectics evi exciplexes exciton excitonic excitons extensivity extracule ez f fand fcc feb fentanyl fermions ferrocyanide finition fjournal fl flavin flavins flavodoxin flavone flavones fluorofuranose fluorouracil fmi fmii fmiii folate folates formamide formhydroxamic fractal freeon fsz fulminic functionals fy g gbre gbv geminal geminals genomic genotoxic ggemann ghede glucosamine glutathione gly glycine glycosides glycylcarbonyl glyoxal glyoxalase gn gorzata gov gramicidin gren gres guanidine guanidines guanidinium guanine guanosine guanylhistamine guez gvk h haloacetic halogenated hannover hardcover harmonically harmonique haya headpiece heliumlike heme heptamer hetero heteroatoms heterobicyclic heteroboranes heteroconjugated heterocycles heterocyclic heteronuclear heterostructures hexachloroiridates hexanitride histamine histamines histidine hler hlich hm homoallylic homonuclear homopolar homotopy hrn htm html http https huckel humidities hybridization hydrogenic hydrogenlike hydroloysis hydrolytic hydrophobe hydrophobicity hydroxyacetone hydroxycytosine hydroxylase hydroxylazoaromatic hydroxytautomeric hydroxytryptamine hydroxyuracil hypercylindrical hypergeometric hyperpolarisabilit hyperpolarisabilite hyperpolarizabilty hypersensitive hyperspherical hypersurface hypersurfaces hypersusceptibilities hyperthermal hypervirial hyponitrous i idempotency iga ijqc imidazole imine imir immobilized imonis indices indoles initio integrability interatomic intercalative interconstituent interhalogens interscience intervalence intra intracellular intracule intramolecular invstigations ionization ionophore iriallene irreversibility isobaric isocyanide isocyanides isocyano isocyanocarbonium isocytosine isodensities isoelectronic isoguanine isomerism isomerization isomers isopentenyl isopotential isoprotonic isostructural isotachysterol isotopomers isoxazole ivka ivkovi j jan jcik jekov jeria jour journalfinder jpages jul jun k ka kb ke keV ket ketonization ki kinase kman kol l l'alg l'espace lac laci lactam lactic lanthanoid lbiewski lcgto le leary lectrons lenius leucine leucomycin lez lfsson libr librational librations libris liganded lin liposomes lithiation lithiumlike lker lkol llebring ller loc lscher lsd ltx lu lucanthone ly lysozyme m macrocyclic manganian mannose mans matricielle meetingname mellitus ments mercaptan mes metastable methanes methano methoxy methoxyl methoxyuracil methylacetamide methylamine methylation methylcholanthrene methylchrysene methylcopper methylenedioxytryptamines methylgiyoxal methylglyoxal methylguanine methylpyrazines methylsilane methylthio methyltransferase metmyoglobin mez mia microcluster microcrystals microlocal microphysical microprobe mimetics min minima mises mispair mispairs mitochondria mitochondrial mitogenesis mitomycin mmel mo moduli mol molekul monoamine monocarbides monochalcogenides monoclinic monocompounds monolayer monolayers monomers mononitrides monophosphate 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nonplanarity nonpolar nonrelativistic nonrelaxed nonresonance nonrigid nonseparable nonstationary nonunitary nonvariational nos nov ns nsson nucleophile nucleophiles nucleophilic nucleoside nucleosides nucleotidyl nyi o observables obtainment obtention oclc oct octahedral octanitro octic odzis ois olefins oligomers oligonucleotides oligosaccharides olmajer olov oncogenes oncoproteins ondulatoire onix onlinedate onova opioid optogalvanic orbitales orbitals ordre org organophosphorus orie orique ortho orthogonalization orthogonalized orthonormality orthorhombic os ouvrage overlayer ovi owski oxatriazole oxene oxetane oxetanes oxetanone oxidase oxidations oxirane oxo oxocarbons oxopregnane oxopyridine oxopyrimidine oxy oxyanions oxyheme p pA pH pK pairons papain para paraissent parameterized parametrization parametrized passivation pathophysiology pdf pendent pentasaccharide pentasulfur peptidoglycan perhalogenated peri permettant permutational peroxidase peroxidation perturbational 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tautomers temps tenseur ter terminer tetra tetrahalides tetrahydroacridine tetramers tetramethylammonium tetramethyls tetramethylsilane tetrapeptides tetraphenyldithiapyranylidene tetrathiofulvalenes tetryl tex tez th thermodynamical therory thio thiocarbonyl thiocarbonyls thione thioxanthenones thromboxane thymine thyrotropin tib tice toc tocopherol toxicology toxicophores toyocamycin trans transaminase transmembrane transversion triazenes trichlorine tricine triclinic trifluoromethyl trifluoromethylamine trihalides trihydrate trimers trinuclear triol troponin tryptamines tryptophan ttner tude tylophorinidine tyr u ub uchler udinger uhm uk ultrafast un uncatalyzed uncoupler underpotentially unimolecular unitarily universitaires unprotonated uracil uracils urawski urcail ureas uridines uslund utah uwdin v valency valinomycin vanDuijnen vanGroenendael vanZandt variational ve vecteurs vibrational vibrationally vibronic vinylguanidinium virial vitro vol volution von vs wavefunction 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