1. A computational investigation of the selectivity and mechanism of the Lewis acid catalyzed oxa‐Diels–Alder cycloaddition of substituted diene with benzaldehyde. Issue 18 (30th April 2021) Authors: Khorief Nacereddine, Abdelmalek; Merzoud, Lynda; Morell, Christophe; Chermette, Henry Journal: Journal of computational chemistry Issue: Volume 42:Issue 18(2021) Page Start: 1296 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. A statistical thermodynamics view of electron density polarisation: application to chemical selectivity. Issue 41 (19th October 2020) Authors: Guégan, Frédéric; Tognetti, Vincent; Martínez-Araya, Jorge I.; Chermette, Henry; Merzoud, Lynda; Toro-Labbé, Alejandro; Morell, Christophe Journal: Physical chemistry chemical physics Issue: Volume 22:Issue 41(2020) Page Start: 23553 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Conformational polymorphism or structural invariance in DNA photoinduced lesions: implications for repair rates. Issue 7 (28th February 2017) Authors: Dehez, François; Gattuso, Hugo; Bignon, Emmanuelle; Morell, Christophe; Dumont, Elise; Monari, Antonio Journal: Nucleic acids research Issue: Volume 45:Issue 7(2017) Page Start: 3654 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Coordination chemistry of Zn2+ with Sal(ph)en ligands: Tetrahedral coordination or penta‐coordination? a DFT analysis. Issue 5 (14th December 2018) Authors: Lamine, Walid; Boughdiri, Salima; Christ, Lorraine; Morell, Christophe; Chermette, Henry Journal: Journal of computational chemistry Issue: Volume 40:Issue 5(2019) Page Start: 717 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. DNA Photosensitization by an "Insider": Photophysics and Triplet Energy Transfer of 5‐Methyl‐2‐pyrimidone Deoxyribonucleoside. Issue 32 (1st July 2015) Authors: Bignon, Emmanuelle; Gattuso, Hugo; Morell, Christophe; Dumont, Elise; Monari, Antonio Journal: Chemistry Issue: Volume 21:Issue 32(2015) Page Start: 11509 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. DNA Photosensitization by an "Insider": Photophysics and Triplet Energy Transfer of 5‐Methyl‐2‐pyrimidone Deoxyribonucleoside. Issue 32 (1st July 2015) Authors: Bignon, Emmanuelle; Gattuso, Hugo; Morell, Christophe; Dumont, Elise; Monari, Antonio Journal: Chemistry Issue: Volume 21:Issue 32(2015) Page Start: 11509 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Does the gradient‐regulated connection improve the description of correlated metal bond properties?. Issue 6 (27th November 2018) Authors: Mostafa, Rola; Brémond, Éric; Adamo, Carlo; Ciofini, Ilaria; Morell, Christophe; Chermette, Henry Journal: International journal of quantum chemistry Issue: Volume 119:Issue 6(2019) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Evidencing under-barrier phenomena in a Yb(iii) SMM: a joint luminescence/neutron diffraction/SQUID study. Issue 11 (25th September 2019) Authors: Guégan, Frédéric; Jung, Julie; Le Guennic, Boris; Riobé, François; Maury, Olivier; Gillon, Béatrice; Jacquot, Jean-François; Guyot, Yannick; Morell, Christophe; Luneau, Dominique Journal: Inorganic chemistry frontiers Issue: Volume 6:Issue 11(2019) Page Start: 3152 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Fluorine substituent effect on the stereochemistry of catalyzed and non-catalyzed Diels–Alder reactions. The case of R-butenone with cyclopentadiene: a computational assessment of the mechanism. Issue 23 (1st June 2018) Authors: Merzoud, Lynda; Saal, Amar; Moussaoui, Ramdane; Ouamerali, Ourida; Morell, Christophe; Chermette, Henry Journal: Physical chemistry chemical physics Issue: Volume 20:Issue 23(2018) Page Start: 16102 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. Ill-advised self-interaction contribution in modelling anionic attack along a reaction path. (17th April 2016) Authors: Lamine, Walid; Boughdiri, Salima; Christ, Lorraine; Morell, Christophe; Chermette, Henry Journal: Molecular physics Issue: Volume 114:Number 7/8(2016) Page Start: 1066 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗