Si vols fer un seminari digues-li-ho a ???
| Data i lloc | Conferenciant | Títol |
|---|---|---|
| Dc 11/Gen/2006 13:00h Seminari del departament |
Núria González UAB |
Finding Saddle-Points by Using the Nudged Elastic Band (NEB) Method: An Implementation For Application to Gas-Phase Systems |
| Dc 25/Gen/2006 13:00h Seminari del departament |
Erika Constantino UAB |
Mass spectrometry applied to Co2+-oligopeptides systems. The use of electrospray ionization technique (ESI) |
| Dc 8/Feb/2006 13:00h Seminari del departament |
Albert Rimola UAB |
Does glycine molecule interact with silica surface? An overview of the CRYSTAL code. |
| Dc 1/Mar/2006 13:00h Sala d'actes del CNM |
Eduard Puig UAB |
Càlculs de pKa en l'enzim Glutamat-Racemasa. |
| Dc 8/Mar/2006 13:00h Sala d'actes del Centre de Recerca Matemàtica |
Josep Maria Lluch UAB |
On the calculation of the kinetic isotope effects in enzyme-catalyzed reactions. A variational transition-state theory study including multidimensional tunneling |
| Dm 21/Mar/2006 12:00h Sala d'actes del CNM |
Piero Ugliengo Dipartimento Chimica IFM, Torino, ITALY |
Role of Calcium Hydroxyapatite in Bioglasses: ab-initio characterization of its surface properties |
| Dc 29/Mar/2006 13:00h Seminari del Departament |
Joe Hayes UAB |
Chiral Separation: Modelling and design of enantioselective receptors using binding free energy calculations |
| Dc 18/Abr/2006 12:00h Sala de Graus II (CREAF C5 parell, 1a planta) |
Motohiro Nishio The CHPI Institute Tokyo, Japan |
The CH/pi hydrogen bond. Implications in chemistry and biochemistry |
| Dc 19/Abr/2006 13:00h Seminari del Departament |
Adrià Gil UAB |
Effects of ionisation on N-Glycylglycine. How ionisation can affect the acidity of the different groups |
| Dc 26/Abr/2006 13:00h Seminari del Departament |
Joseph J. Dannenberg Hunter College, City University of New York |
The Extraordinarily Flexible Properties of N-H...O=C H-Bonds. How Nature and Man use it to make Natural and Synthetic Materials |
| Dc 3/Mai/2006 13:00h Seminari del Departament |
Galí Drudis-Solé UAB |
EQM: An alternative to QM in QM/MM |
| Dc 24/Mai/2006 13:00h Seminari del Departament |
Raquel Bielsa Universidad de Zaragoza |
Sythesis, reactivity and catalytic activity of orthometallated iminophosphoranes |
| Dc 31/Mai/2006 13:00h Sala d'actes CNM |
Joaquín López Serrano Department of Chemistry, University of York, UK |
Palladium catalysed hydrogenation: detection of palladium hydrides, a joint study by parahydrogen enhanced NMR spectroscopy and density functional theory. |
| Dl 19/Jun/2006 11:30h Seminari del departament |
Juergen Eckert Los Alamos National Laboratory and University of California, Santa Barbara |
Modes of binding of molecular hydrogen and their implications for hydrogen storage materials. |
| Dc 28/Jun/2006 12:00h Seminari del departament |
Carles Acosta UAB |
A comparison of DFT functionals for epoxidation and cyclopropanation reactions |