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chlorosome. 600 Bchl-d moleculeshttps://joaquinbarroso.com/wp-content/uploads/2017/08/fmo.jpgFMOFMO Complex. Trimer, monomer, pigmentshttps://joaquinbarroso.com/wp-content/uploads/2017/08/imagen1.pngImagen12023-11-15T19:16:02+00:00monthlyhttps://joaquinbarroso.com/2017/08/21/a-new-graduate-student-medicinal-compchem-on-hiv-1/https://joaquinbarroso.com/wp-content/uploads/2017/08/img-20170820-wa0040.jpgIMG-20170820-WA0040Dr. Antonio Romo, Me, Durbis, Dr. Nelly Gonzalez, Dr. Moises Romerohttps://joaquinbarroso.com/wp-content/uploads/2017/08/img-20170820-wa0039.jpgIMG-20170820-WA0039https://joaquinbarroso.com/wp-content/uploads/2017/08/dsc_0166.jpgDSC_0166Current group members2017-08-21T05:58:10+00:00monthlyhttps://joaquinbarroso.com/2017/08/10/all-you-wanted-to-know-about-hybrid-orbitals/https://joaquinbarroso.com/wp-content/uploads/2017/08/2017-08-09-20-29-45-e1502328911658.jpg2017-08-09 20.29.45Taken from "Quantum Mechanics in Chemistry" by Jack Simmonshttps://joaquinbarroso.com/wp-content/uploads/2017/08/imagen1.jpgImagen12017-12-17T09:02:13+00:00monthlyhttps://joaquinbarroso.com/2017/07/26/no-seriously-why-cant-orbitals-be-observed/2017-12-13T02:05:28+00:00monthlyhttps://joaquinbarroso.com/2017/07/17/compchem-can-orbitals-be-directly-observed/2017-09-27T20:07:00+00:00monthlyhttps://joaquinbarroso.com/2017/07/11/the-gossip-approach-to-scientific-writing/2017-07-11T14:55:24+00:00monthlyhttps://joaquinbarroso.com/2017/06/28/some-comp-chem-tweeps/2017-07-07T07:08:40+00:00monthlyhttps://joaquinbarroso.com/2017/06/20/dealing-with-spin-contamination/2022-06-11T10:11:49+00:00monthlyhttps://joaquinbarroso.com/2017/04/19/stability-of-unnatural-dna-pccp-compchem/https://joaquinbarroso.com/wp-content/uploads/2017/04/fig3.jpgfig3three UBPshttps://joaquinbarroso.com/wp-content/uploads/2017/04/fig2.jpgfig2one UBP2017-04-19T07:36:22+00:00monthlyhttps://joaquinbarroso.com/2017/03/29/im-putting-a-new-blog-out-there/2017-03-30T21:24:10+00:00monthlyhttps://joaquinbarroso.com/2017/03/28/unnatural-dna-and-synthetic-biology/https://joaquinbarroso.com/wp-content/uploads/2017/03/imagen1.jpgImagen12017-03-28T15:19:20+00:00monthlyhttps://joaquinbarroso.com/2017/03/08/grimmes-dispersion-dft-d3-in-gaussian-compchem/2024-11-13T13:47:39+00:00monthlyhttps://joaquinbarroso.com/2017/02/21/is-open-access-a-first-world-problem/2017-02-28T05:12:30+00:00monthlyhttps://joaquinbarroso.com/2017/02/08/women-in-compchem-and-all-stem/2017-02-09T02:02:38+00:00monthlyhttps://joaquinbarroso.com/2016/12/28/annual-state-of-the-research-group/https://joaquinbarroso.com/wp-content/uploads/2016/12/2016-12-14-16-18-07.jpg2016-12-14-16-18-07https://joaquinbarroso.com/wp-content/uploads/2016/12/2016-11-16-22-38-14.jpg2016-11-16-22-38-142017-01-16T11:38:50+00:00monthlyhttps://joaquinbarroso.com/2016/11/29/finite-elements-chemistry/2016-11-30T03:07:40+00:00monthlyhttps://joaquinbarroso.com/2016/11/21/mexican-phys-chem-meeting-xvth-edition/https://joaquinbarroso.com/wp-content/uploads/2016/11/img_5719-1.jpgimg_5719-1https://joaquinbarroso.com/wp-content/uploads/2016/11/img_5723.jpgimg_5723https://joaquinbarroso.com/wp-content/uploads/2016/11/img_5725.jpgimg_5725https://joaquinbarroso.com/wp-content/uploads/2016/11/img_5721.jpgimg_5721https://joaquinbarroso.com/wp-content/uploads/2016/11/img_5720.jpgimg_5720https://joaquinbarroso.com/wp-content/uploads/2016/11/img_5724.jpgimg_5724https://joaquinbarroso.com/wp-content/uploads/2016/11/img_5722.jpgimg_5722https://joaquinbarroso.com/wp-content/uploads/2016/11/img_5719.jpgimg_5719https://joaquinbarroso.com/wp-content/uploads/2016/11/img_5718.jpgimg_5718https://joaquinbarroso.com/wp-content/uploads/2016/11/img_5712.jpgimg_57122016-11-21T16:22:11+00:00monthlyhttps://joaquinbarroso.com/2016/11/16/tribology-new-paper-in-jpc-a/https://joaquinbarroso.com/wp-content/uploads/2016/11/picture4.jpgpicture4https://joaquinbarroso.com/wp-content/uploads/2016/11/picture3.jpgpicture3https://joaquinbarroso.com/wp-content/uploads/2016/11/picture2.jpgpicture2https://joaquinbarroso.com/wp-content/uploads/2016/11/picture1.jpgpicture12017-05-22T17:06:42+00:00monthlyhttps://joaquinbarroso.com/2016/10/06/back-in-pecsi-tudomanyegyetem-hungary/https://joaquinbarroso.com/wp-content/uploads/2016/10/2016-10-04-10-50-03.jpg2016-10-04-10-50-03https://joaquinbarroso.com/wp-content/uploads/2016/10/2016-10-04-09-01-18-2.jpg2016-10-04-09-01-18-2https://joaquinbarroso.com/wp-content/uploads/2016/10/2016-10-06-11-03-22.jpg2016-10-06-11-03-22https://joaquinbarroso.com/wp-content/uploads/2016/10/2016-10-06-10-16-46.jpg2016-10-06-10-16-462016-10-07T10:14:08+00:00monthlyhttps://joaquinbarroso.com/2016/09/21/new-paper-in-pccp-ccl3-reduced-to-ch3-through-%cf%83-holes-compchem/https://joaquinbarroso.com/wp-content/uploads/2016/09/fig3-blog.pngfig3-bloghttps://joaquinbarroso.com/wp-content/uploads/2016/09/fig1-blog1.pngfig1-bloghttps://joaquinbarroso.com/wp-content/uploads/2016/09/fig2-blog.pngfig2-bloghttps://joaquinbarroso.com/wp-content/uploads/2016/09/fig1-blog.pngfig1-blog2016-09-21T00:32:08+00:00monthlyhttps://joaquinbarroso.com/2016/06/28/quick-note-on-wfnx-files-and-mp2-calculations-g09-compchem/2016-08-04T17:46:58+00:00monthlyhttps://joaquinbarroso.com/2016/06/24/a-new-graduate-student/https://joaquinbarroso.com/wp-content/uploads/2016/06/2016-06-16-13-28-58.jpg2016-06-16 13.28.58https://joaquinbarroso.com/wp-content/uploads/2016/06/2016-06-16-13-28-20.jpg2016-06-16 13.28.20https://joaquinbarroso.com/wp-content/uploads/2016/06/2016-06-16-13-28-16.jpg2016-06-16 13.28.16https://joaquinbarroso.com/wp-content/uploads/2016/06/2016-06-16-13-18-52.jpg2016-06-16 13.18.522016-09-07T08:34:58+00:00monthlyhttps://joaquinbarroso.com/2016/06/15/new-paper-in-tetrahedron-compchem-why-u-dont-react/https://joaquinbarroso.com/wp-content/uploads/2016/06/fig4.pngfig4https://joaquinbarroso.com/wp-content/uploads/2016/06/fig3.pngfig3https://joaquinbarroso.com/wp-content/uploads/2016/06/fig2.pngfig2https://joaquinbarroso.com/wp-content/uploads/2016/06/fig1.pngfig1https://joaquinbarroso.com/wp-content/uploads/2016/06/test.pngTEST2016-06-16T17:56:34+00:00monthlyhttps://joaquinbarroso.com/2016/05/31/the-art-of-finding-transition-states-part-2/https://joaquinbarroso.com/wp-content/uploads/2016/05/ts_irc.pngTS_IRChttps://joaquinbarroso.com/wp-content/uploads/2016/05/ts_flow.pngTS_Flowhttps://joaquinbarroso.com/wp-content/uploads/2016/05/ts_scheme_2.jpgTS_Scheme_2https://joaquinbarroso.com/wp-content/uploads/2016/05/ts_scheme_1.jpgTS_Scheme_12016-10-22T00:42:06+00:00monthlyhttps://joaquinbarroso.com/2016/05/26/the-art-of-finding-transition-states-part-1/https://joaquinbarroso.com/wp-content/uploads/2016/05/guillermo-caballero.jpgGuillermo Caballero2021-01-20T10:25:11+00:00monthlyhttps://joaquinbarroso.com/2016/04/29/new-paper-in-jiph-asvcalixnarenes/https://joaquinbarroso.com/wp-content/uploads/2016/04/fig6.jpgFig6https://joaquinbarroso.com/wp-content/uploads/2016/04/fig5.jpgFig5https://joaquinbarroso.com/wp-content/uploads/2016/04/fig4.jpgFig4https://joaquinbarroso.com/wp-content/uploads/2016/04/fig3.jpgFig32016-04-30T02:49:48+00:00monthlyhttps://joaquinbarroso.com/2016/04/27/maru-sandoval-our-first-m-sc-graduate/https://joaquinbarroso.com/wp-content/uploads/2016/04/2016-04-22-11-27-03.jpg2016-04-22 11.27.03https://joaquinbarroso.com/wp-content/uploads/2016/04/2016-04-22-10-43-37.jpg2016-04-22 10.43.37https://joaquinbarroso.com/wp-content/uploads/2016/04/p220416_10-35.jpgBALIBALIhttps://joaquinbarroso.com/wp-content/uploads/2016/04/dscf6776.jpgDSCF6776https://joaquinbarroso.com/wp-content/uploads/2016/04/dscf6775.jpgDSCF6775https://joaquinbarroso.com/wp-content/uploads/2016/04/dscf6773.jpgDSCF6773https://joaquinbarroso.com/wp-content/uploads/2016/04/dscf67641.jpgDSCF6764https://joaquinbarroso.com/wp-content/uploads/2016/04/dscf6764.jpgDSCF67642016-04-29T01:29:45+00:00monthlyhttps://joaquinbarroso.com/2016/01/27/internal-symposium-at-cciqs-2016-edition/https://joaquinbarroso.com/wp-content/uploads/2016/01/12583940_10208150253978588_2003935644_n.jpg12583940_10208150253978588_2003935644_nhttps://joaquinbarroso.com/wp-content/uploads/2016/01/12607222_1012520975458536_1407918310_n.jpg12607222_1012520975458536_1407918310_nhttps://joaquinbarroso.com/wp-content/uploads/2016/01/12509017_1028030207238711_9213561299333911433_n.jpg12509017_1028030207238711_9213561299333911433_nHanging out at my office (LR, Guillermo, Gustavo, Me, Maru, Marycarmen, Durbis)https://joaquinbarroso.com/wp-content/uploads/2016/01/2016-01-22-12-55-01.jpg2016-01-22 12.55.01https://joaquinbarroso.com/wp-content/uploads/2016/01/2016-01-22-13-44-49.jpg2016-01-22 13.44.49https://joaquinbarroso.com/wp-content/uploads/2016/01/2016-01-22-13-40-40.jpg2016-01-22 13.40.402016-01-28T17:01:45+00:00monthlyhttps://joaquinbarroso.com/2015/12/31/new-paper-in-jcc-drug-delivery-agents/2015-12-31T15:37:41+00:00monthlyhttps://joaquinbarroso.com/2015/11/25/xiv-mexican-reunion-on-theoretical-physical-chemistry/2015-11-25T22:07:45+00:00monthlyhttps://joaquinbarroso.com/2015/11/17/a-personal-artistic-impression-of-the-compchem-landscape/https://joaquinbarroso.com/wp-content/uploads/2015/11/birds-animals-kingfisher-2560x1440-wallpaper_www-wallpaperfo-com_61.jpgbirds animals kingfisher 2560x1440 wallpaper_www.wallpaperfo.com_61In this case, shutter speed is keyhttps://joaquinbarroso.com/wp-content/uploads/2015/11/altamirabison.jpgAltamiraBisonAltamira Cave Paintings - Spainhttps://joaquinbarroso.com/wp-content/uploads/2015/11/the_scream.jpgThe_Screamhttps://joaquinbarroso.com/wp-content/uploads/2015/11/claude_monet_023.jpgClaude_Monet_023Woman with a parasol - Her face or the identity of the flowers at her feet are indistinguishable yet we might be safe to say its springtime. https://joaquinbarroso.com/wp-content/uploads/2015/11/ethelred_the_unready.jpgEthelred_the_UnreadyÆthelred the Unready King of England ca. 1000 BChttps://joaquinbarroso.com/wp-content/uploads/2015/11/flaming_june_by_frederic_lord_leighton_1830-1896.jpgFlaming_June,_by_Frederic_Lord_Leighton_(1830-1896)https://joaquinbarroso.com/wp-content/uploads/2015/11/bestias11.jpgBestias11Cave of Beasts - Egypthttps://joaquinbarroso.com/wp-content/uploads/2015/11/switchingfromcanont-sony_photo_3.jpgSwitchingfromCanont-Sony_Photo_3The selected lens gives the viewer the sense of depth due to the non-isomorphic distortion but the bridge is straighthttps://joaquinbarroso.com/wp-content/uploads/2015/11/magrittepipe.jpgMagrittePipe2015-11-17T07:00:08+00:00monthlyhttps://joaquinbarroso.com/2015/11/09/partial-optimizations-with-gaussian09/2023-01-05T18:44:05+00:00monthlyhttps://joaquinbarroso.com/2015/10/27/comparing-the-relative-stability-of-non-equivalent-molecules/https://joaquinbarroso.com/wp-content/uploads/2015/10/figure01.jpgfigure01Figure 1. Compound 1 exists but compound 2 is apparently less stable. Is it?2015-11-09T10:23:36+00:00monthlyhttps://joaquinbarroso.com/2015/10/19/singlet-fission-in-the-fenna-matthews-olson-complex-a-talk/2015-10-19T15:14:52+00:00monthlyhttps://joaquinbarroso.com/2015/10/13/restarting-calculations-from-rwf-files-gaussian/2023-01-27T04:19:53+00:00monthlyhttps://joaquinbarroso.com/2015/08/28/fluorescent-chemosensors-for-chloride-in-water-sensors-and-actuators-b-chemical/https://joaquinbarroso.com/wp-content/uploads/2015/08/fmos.jpgFMOsFrontier Molecular Orbitalshttps://joaquinbarroso.com/wp-content/uploads/2015/08/sensors.jpgSensors2018-03-06T10:15:44+00:00monthlyhttps://joaquinbarroso.com/2015/08/25/simulation-of-raman-spectroscopy-and-crystal-cell-effects-selenium-carboxylate-eur-j-inorg-chem/https://joaquinbarroso.com/wp-content/uploads/2015/08/test.jpgtestSingle Moleculehttps://joaquinbarroso.com/wp-content/uploads/2015/08/cryst.jpgcrystCrystal Unit Cellhttps://joaquinbarroso.com/wp-content/uploads/2015/08/experimental.jpgExperimentalExperimental 2015-08-25T18:43:46+00:00monthlyhttps://joaquinbarroso.com/2015/07/01/toga-party-no-not-that-kind-at-unam/https://joaquinbarroso.com/wp-content/uploads/2015/07/dsc_0183.jpgDSC_0183Building 'B' from the Chemistry Schoolhttps://joaquinbarroso.com/wp-content/uploads/2015/07/dsc_0177.jpgDSC_0177https://joaquinbarroso.com/wp-content/uploads/2015/07/dsc_0174.jpgDSC_0174My wife and our baby, future doctor!https://joaquinbarroso.com/wp-content/uploads/2015/07/dsc_0170.jpgDSC_0170My sister (soon to be) Dr. Janet Barroso and Ihttps://joaquinbarroso.com/wp-content/uploads/2015/07/dsc_0165.jpgDSC_0165My good friend Dr. Paula García-Reynaldos and Ihttps://joaquinbarroso.com/wp-content/uploads/2015/07/dsc_0163.jpgDSC_0163My good friend Dr. Paula García-Reynaldos and Ihttps://joaquinbarroso.com/wp-content/uploads/2015/07/dsc_0152.jpgDSC_0152My parentshttps://joaquinbarroso.com/wp-content/uploads/2015/07/dsc_0146.jpgDSC_0146https://joaquinbarroso.com/wp-content/uploads/2015/07/dsc_0143.jpgDSC_0143My good friend Dr. Eugenia Aldeco-Pérezhttps://joaquinbarroso.com/wp-content/uploads/2015/07/dsc_0122.jpgDSC_01222015-07-01T19:33:57+00:00monthlyhttps://joaquinbarroso.com/2015/06/17/a-new-chemist-is-graduated/2022-01-03T05:35:08+00:00monthlyhttps://joaquinbarroso.com/2015/06/12/symposium-at-unam/2015-06-15T15:08:13+00:00monthlyhttps://joaquinbarroso.com/2015/05/20/efficient-use-of-the-clipboard-on-gaussview/https://joaquinbarroso.com/wp-content/uploads/2015/05/clipboard4.pngclipboard4Bind and twist!https://joaquinbarroso.com/wp-content/uploads/2015/05/clipboard3.pngclipboard3Select 'Hot' atomhttps://joaquinbarroso.com/wp-content/uploads/2015/05/clipboard2.pngclipboard2Copy the active onehttps://joaquinbarroso.com/wp-content/uploads/2015/05/clipboard1.pngclipboard1Open your fragments2015-05-20T21:30:25+00:00monthlyhttps://joaquinbarroso.com/2015/05/14/new-liquid-nitrogen-plant-at-cciqs/https://joaquinbarroso.com/wp-content/uploads/2015/05/foto-5-13-15-12-32-11.jpgFoto 5-13-15 12 32 11https://joaquinbarroso.com/wp-content/uploads/2015/05/foto-5-13-15-12-30-39.jpgFoto 5-13-15 12 30 39https://joaquinbarroso.com/wp-content/uploads/2015/05/foto-5-13-15-12-30-28.jpgFoto 5-13-15 12 30 28https://joaquinbarroso.com/wp-content/uploads/2015/05/foto-5-13-15-12-29-26.jpgFoto 5-13-15 12 29 26https://joaquinbarroso.com/wp-content/uploads/2015/05/foto-5-13-15-12-27-11.jpgNew Equipment!Arrival of fancy new equipment is always cool!2015-05-14T20:48:54+00:00monthlyhttps://joaquinbarroso.com/2015/05/05/on-being-scooped-and-worse-things/2015-05-07T16:36:30+00:00monthlyhttps://joaquinbarroso.com/2015/02/17/rank-your-qm-knowledge-according-to-paulis-exclusion-principle/https://joaquinbarroso.com/wp-content/uploads/2015/02/child-messy-8207.jpgChild-Messy-8207https://joaquinbarroso.com/wp-content/uploads/2015/02/exclusion-principle.jpgexclusion principleQM Evolutionary tree!2015-10-15T17:09:22+00:00monthlyhttps://joaquinbarroso.com/2014/12/04/two-more-students-graduated/https://joaquinbarroso.com/wp-content/uploads/2014/12/dsc_0567.jpgDSC_0567https://joaquinbarroso.com/wp-content/uploads/2014/12/library.jpglibrarySome of the compounds exploredhttps://joaquinbarroso.com/wp-content/uploads/2014/12/detail.jpgdetailOne by one the interactions with the cavity were calculatedhttps://joaquinbarroso.com/wp-content/uploads/2014/12/cavity.jpgcavityCavity was explored with 6 known blockershttps://joaquinbarroso.com/wp-content/uploads/2014/12/howard.jpghowardHoward after his defensehttps://joaquinbarroso.com/wp-content/uploads/2014/12/memomorelia.jpgmemomoreliaA man and his workhttps://joaquinbarroso.com/wp-content/uploads/2014/12/pathsnme2.jpgpathsNMe2Two reaction mechanisms. Without different substituents the transformation is not possible. https://joaquinbarroso.com/wp-content/uploads/2014/12/memo.jpgMemo after his defense2020-09-29T00:06:38+00:00monthlyhttps://joaquinbarroso.com/2014/12/18/new-paper-in-jpc-a/https://joaquinbarroso.com/wp-content/uploads/2014/12/jpca.jpgjpca2015-02-18T03:48:45+00:00monthlyhttps://joaquinbarroso.com/2014/11/27/rmfqt2014/https://joaquinbarroso.com/wp-content/uploads/2014/11/img_20141106_151552_071.jpgIMG_20141106_151552_071Materials Research Institute at Morelia Michoacan (southern Mexico)https://joaquinbarroso.com/wp-content/uploads/2014/11/foto-11-11-14-10-02-02.jpgFoto 11-11-14 10 02 02https://joaquinbarroso.com/wp-content/uploads/2014/11/foto-11-11-14-10-01-58.jpgFoto 11-11-14 10 01 58https://joaquinbarroso.com/wp-content/uploads/2014/11/foto-11-11-14-9-58-23.jpgFoto 11-11-14 9 58 23https://joaquinbarroso.com/wp-content/uploads/2014/11/foto-11-10-14-18-34-091.jpgFoto 11-10-14 18 34 09The boys from the labhttps://joaquinbarroso.com/wp-content/uploads/2014/11/foto-11-10-14-18-34-09.jpgFoto 11-10-14 18 34 09https://joaquinbarroso.com/wp-content/uploads/2014/11/img_20141107_184857_856.jpgIMG_20141107_184857_856"Kike" Aguilar - Calix[n]arenes as drug carriers for Bosutinib and Sorafenibhttps://joaquinbarroso.com/wp-content/uploads/2014/11/img_20141107_184910_288.jpgIMG_20141107_184910_288Howard Diaz - GP120 blockers for HIV-1https://joaquinbarroso.com/wp-content/uploads/2014/11/img_20141107_190300_192.jpgIMG_20141107_190300_1922014-11-27T19:08:44+00:00monthlyhttps://joaquinbarroso.com/2014/10/30/aim-qtaim/https://joaquinbarroso.com/wp-content/uploads/2014/10/fig4.jpgfig4Figure 4https://joaquinbarroso.com/wp-content/uploads/2014/10/fig3.jpgfig3Figure 3https://joaquinbarroso.com/wp-content/uploads/2014/10/fig2.jpgfig2Figure 2https://joaquinbarroso.com/wp-content/uploads/2014/10/fig1.jpgfig1Figure 12016-07-26T07:59:28+00:00monthlyhttps://joaquinbarroso.com/2013/10/24/negotiations-in-science/2014-10-23T21:18:14+00:00monthlyhttps://joaquinbarroso.com/2014/10/14/watoc-2014-virtual-edition/https://joaquinbarroso.com/wp-content/uploads/2014/10/diapositiva29.jpgDiapositiva29(The view from my office in Toluca) Any questions?https://joaquinbarroso.com/wp-content/uploads/2014/10/diapositiva28.jpgDiapositiva28Thanks to all of these wonderful guys who made all publications possible (and also those who gave the money)https://joaquinbarroso.com/wp-content/uploads/2014/10/diapositiva27.jpgDiapositiva27https://joaquinbarroso.com/wp-content/uploads/2014/10/diapositiva26.jpgDiapositiva26https://joaquinbarroso.com/wp-content/uploads/2014/10/diapositiva25.jpgDiapositiva25Also, Imatinib is cardiotoxic. We research now the competence between allegedly affected enzymes and the carriers to at least delay the toxic effect.https://joaquinbarroso.com/wp-content/uploads/2014/10/diapositiva24.jpgDiapositiva24I know, some results need some attention, I know, trust me.https://joaquinbarroso.com/wp-content/uploads/2014/10/diapositiva23.jpgDiapositiva23A comercial error has released two isomers to the market, only one of them actually works. CAN WE GENERATE A RECOGNITION AGENT??https://joaquinbarroso.com/wp-content/uploads/2014/10/diapositiva22.jpgDiapositiva22Second generation CML drugs; however Bosutinib poses a funny challengehttps://joaquinbarroso.com/wp-content/uploads/2014/10/diapositiva21.jpgDiapositiva21Where do we go from here?https://joaquinbarroso.com/wp-content/uploads/2014/10/diapositiva20.jpgDiapositiva20PMF US - the profile of release tells us if the carrier is way too strong to be a carrier at all.2014-10-23T21:01:13+00:00monthlyhttps://joaquinbarroso.com/2014/10/08/watoc-2014/2014-10-08T13:45:48+00:00monthlyhttps://joaquinbarroso.com/2014/08/09/248th-acs-meeting-san-francisco-2014/2014-08-09T13:49:06+00:00monthlyhttps://joaquinbarroso.com/2014/07/10/new-paper-in-jacs/https://joaquinbarroso.com/wp-content/uploads/2014/07/mapdens.pngmapdensElectrostatic potential mapped onto the electron density surface of one of the aducts under studyhttps://joaquinbarroso.com/wp-content/uploads/2014/07/ga.pngga(Ligands: Green = Chloride; Blue = Cyanide)2016-01-09T18:28:07+00:00monthlyhttps://joaquinbarroso.com/2014/06/24/summer-interns/https://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-24-14-11-05-50.jpgPhoto 6-24-14 11 05 50My overweight self - Interns in the backgroundhttps://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-24-14-11-03-18.jpgPhoto 6-24-14 11 03 18https://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-24-14-11-02-36.jpgPhoto 6-24-14 11 02 36Left to right: Karen Díaz, Cynthia González, Marco Linares and Jesús Beltránhttps://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-24-14-11-02-31.jpgPhoto 6-24-14 11 02 31Left to right: Karen Díaz, Cynthia González, Marco Linares and Jesús Beltrán2014-06-25T10:34:01+00:00monthlyhttps://joaquinbarroso.com/2014/06/18/unca/https://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-6-14-16-14-20.jpgPhoto 6-6-14 16 14 20UNCAhttps://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-6-14-15-35-44.jpgPhoto 6-6-14 15 35 44https://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-6-14-14-15-36.jpgPhoto 6-6-14 14 15 36https://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-6-14-11-55-31.jpgPhoto 6-6-14 11 55 31Me, Eduardo, Albertohttps://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-6-14-10-05-05.jpgPhoto 6-6-14 10 05 05https://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-6-14-9-51-48.jpgPhoto 6-6-14 9 51 48https://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-6-14-9-34-44.jpgPhoto 6-6-14 9 34 44https://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-6-14-9-04-35.jpgPhoto 6-6-14 9 04 35Some arachnidshttps://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-6-14-8-24-46.jpgPhoto 6-6-14 8 24 46https://joaquinbarroso.com/wp-content/uploads/2014/06/photo-6-6-14-8-24-33.jpgPhoto 6-6-14 8 24 332014-06-17T23:54:55+00:00monthlyhttps://joaquinbarroso.com/2014/06/11/science_world_cup/2014-06-12T15:25:29+00:00monthlyhttps://joaquinbarroso.com/2014/06/09/children-home/https://joaquinbarroso.com/wp-content/uploads/2014/06/foto-30-05-14-13-36-25.jpgFoto 30-05-14 13 36 25https://joaquinbarroso.com/wp-content/uploads/2014/06/foto-30-05-14-13-13-45.jpgFoto 30-05-14 13 13 45https://joaquinbarroso.com/wp-content/uploads/2014/06/foto-30-05-14-13-12-53.jpgFoto 30-05-14 13 12 53https://joaquinbarroso.com/wp-content/uploads/2014/06/foto-30-05-14-12-51-05.jpgFoto 30-05-14 12 51 05https://joaquinbarroso.com/wp-content/uploads/2014/06/foto-30-05-14-12-49-46.jpgFoto 30-05-14 12 49 46https://joaquinbarroso.com/wp-content/uploads/2014/06/foto-30-05-14-12-40-43.jpgFoto 30-05-14 12 40 43https://joaquinbarroso.com/wp-content/uploads/2014/06/foto-30-05-14-12-36-21.jpgFoto 30-05-14 12 36 21https://joaquinbarroso.com/wp-content/uploads/2014/06/foto-30-05-14-12-34-35.jpgFoto 30-05-14 12 34 35https://joaquinbarroso.com/wp-content/uploads/2014/06/foto-30-05-14-13-47-02.jpgFoto 30-05-14 13 47 02https://joaquinbarroso.com/wp-content/uploads/2014/06/foto-30-05-14-13-46-29.jpgFoto 30-05-14 13 46 292014-10-16T21:30:03+00:00monthlyhttps://joaquinbarroso.com/2014/05/07/if-a-fchk-file-wont-open-in-gaussview5-0/2023-01-27T10:46:34+00:00monthlyhttps://joaquinbarroso.com/2014/05/19/some-fchk-files-wont-open-in-gaussview5-0-update/2024-06-27T02:45:12+00:00monthlyhttps://joaquinbarroso.com/2014/04/30/virtual-conference-in-computational-chemistry-vccc-2014/2015-01-18T08:11:31+00:00monthlyhttps://joaquinbarroso.com/2014/03/13/paper-ctc/https://joaquinbarroso.com/wp-content/uploads/2014/03/imagen1.pngImagen1NBO Del interaction energies B97D/6-31G(d,p)https://joaquinbarroso.com/wp-content/uploads/2014/03/fig4-delete.pngfig4-deleteFig 1. Calixarenes under study and their complexes with GTPhttps://joaquinbarroso.com/wp-content/uploads/2014/03/calixused.pngcalixusedhttps://joaquinbarroso.com/wp-content/uploads/2014/03/fig8.pngfig8https://joaquinbarroso.com/wp-content/uploads/2014/03/fig6.pngfig6Donor and acceptor H-bond sites increases the probability of keeping the drug in place for a higher retention rate2014-03-13T16:45:07+00:00monthlyhttps://joaquinbarroso.com/2014/02/21/symposium-2014/https://joaquinbarroso.com/wp-content/uploads/2014/02/20140220-221653.jpg20140220-221653.jpghttps://joaquinbarroso.com/wp-content/uploads/2014/02/20140220-221638.jpg20140220-221638.jpghttps://joaquinbarroso.com/wp-content/uploads/2014/02/20140220-221627.jpg20140220-221627.jpghttps://joaquinbarroso.com/wp-content/uploads/2014/02/20140220-221553.jpg20140220-221553.jpg2014-08-21T09:07:15+00:00monthlyhttps://joaquinbarroso.com/2014/02/03/elements4d-exploring-chemistry-with-augmented-reality/2014-03-05T21:20:49+00:00monthlyhttps://joaquinbarroso.com/2014/01/23/nice-energy-level-diagrams-with-rxnlvl/2014-03-05T21:03:42+00:00monthlyhttps://joaquinbarroso.com/2014/01/09/jctc/https://joaquinbarroso.com/wp-content/uploads/2014/01/structs.jpgstructsGeneral MD simulation final structureshttps://joaquinbarroso.com/wp-content/uploads/2014/01/pmf.jpgPMFPMF for the most stable compoundshttps://joaquinbarroso.com/wp-content/uploads/2014/01/imagen1.pngImagen1Optimized geometries for all complexes under study (B97D/6-31G*)https://joaquinbarroso.com/wp-content/uploads/2014/01/fig8_jctc.jpgfig8_JCTC2014-09-19T00:21:09+00:00monthlyhttps://joaquinbarroso.com/2013/12/19/2013-2014/2014-03-05T20:56:28+00:00monthlyhttps://joaquinbarroso.com/2013/11/27/qst2-qst3/https://joaquinbarroso.com/wp-content/uploads/2013/11/dead-simple-trick-getting-chips-out-pringles-can-fast-mess-free-w654.jpgdead-simple-trick-getting-chips-out-pringles-can-fast-mess-free.w654Fig 1a Pringles chips -Yuck-. They exhibit a maximum on the direction parallel to the screen and a minimum on the direction perpendicular to the screen at the same point.https://joaquinbarroso.com/wp-content/uploads/2013/11/400px-saddle_point.png400px-Saddle_point2022-04-11T21:38:34+00:00monthlyhttps://joaquinbarroso.com/2013/11/20/xii-rmfqt/https://joaquinbarroso.com/wp-content/uploads/2013/11/diapositiva1.pngDiapositiva1Full Posterhttps://joaquinbarroso.com/wp-content/uploads/2013/11/eprofile.pngEprofileEnergy Profilehttps://joaquinbarroso.com/wp-content/uploads/2013/11/mechanism1.pngmechanismhttps://joaquinbarroso.com/wp-content/uploads/2013/11/equilibrium.pngequilibriumhttps://joaquinbarroso.com/wp-content/uploads/2013/11/mechanism.pngmechanismEnergy profile for the transformation under studyhttps://joaquinbarroso.com/wp-content/uploads/2013/11/20131119-154222.jpg20131119-154222.jpghttps://joaquinbarroso.com/wp-content/uploads/2013/11/20131119-154102.jpg20131119-154102.jpghttps://joaquinbarroso.com/wp-content/uploads/2013/11/20131119-154119.jpg20131119-154119.jpghttps://joaquinbarroso.com/wp-content/uploads/2013/11/20131119-154028.jpg20131119-154028.jpg2013-11-20T06:24:07+00:00monthlyhttps://joaquinbarroso.com/2013/10/15/nobel-prize-chem-2013/https://joaquinbarroso.com/wp-content/uploads/2013/10/2013-nobel-prize-chemistry2.jpgnobelchem2013Nobel Laureates in Chemistry 2013 (source: NBC.com)2013-10-19T14:37:36+00:00monthlyhttps://joaquinbarroso.com/2013/09/25/my-take-on-gmos/2022-02-23T09:44:23+00:00monthlyhttps://joaquinbarroso.com/2013/09/10/how-to-read-a-scientific-paper/2019-04-20T03:29:59+00:00monthlyhttps://joaquinbarroso.com/2013/09/06/more-interns/https://joaquinbarroso.com/wp-content/uploads/2013/09/20130905-235410.jpg20130905-235410.jpghttps://joaquinbarroso.com/wp-content/uploads/2013/09/20130905-235352.jpg20130905-235352.jpghttps://joaquinbarroso.com/wp-content/uploads/2013/09/20130905-235321.jpg20130905-235321.jpg2013-09-06T05:10:01+00:00monthlyhttps://joaquinbarroso.com/2013/07/30/summer-internships-are-over/https://joaquinbarroso.com/wp-content/uploads/2013/07/javier_delfin_2013.jpgJavier_Delfin_2013https://joaquinbarroso.com/wp-content/uploads/2013/07/la-foto.jpgla foto2013-08-01T19:29:17+00:00monthlyhttps://joaquinbarroso.com/2013/06/26/summer-internships/https://joaquinbarroso.com/wp-content/uploads/2013/06/20130626-122705.jpg20130626-122705.jpg2014-09-24T08:23:25+00:00monthlyhttps://joaquinbarroso.com/2013/05/30/first-graduated/https://joaquinbarroso.com/wp-content/uploads/2013/05/468845_10151631368510827_489957784_o-e1369948755199.jpg468845_10151631368510827_489957784_oTaking the Oath after being unanimously approved2013-06-03T21:50:55+00:00monthlyhttps://joaquinbarroso.com/2013/04/25/realtimechem-happy-birthday-dna/https://joaquinbarroso.com/wp-content/uploads/2013/04/112238-1_largest_human_dna_helix_genentech.jpg112238-1_largest_human_DNA_helix_GenentechGenetech SF, Cal. USA (Source worldrecordacademy.com)https://joaquinbarroso.com/wp-content/uploads/2013/04/dna_orbit_animated_static_thumb.pngDNA_orbit_animated_static_thumbModern DNA representation (Source: Wikipedia)https://joaquinbarroso.com/wp-content/uploads/2013/04/photo_51_x-ray_diffraction_image.jpgPhoto_51_x-ray_diffraction_imageFamous Photo 51 by Dr. Rosalind Franklin and Raymond Gosling (Source: Wikipedia)2014-09-24T11:48:59+00:00monthlyhttps://joaquinbarroso.com/2013/04/24/realtimechem-day-3/2013-04-25T05:20:28+00:00monthlyhttps://joaquinbarroso.com/2013/04/19/journalofphysicalchemistryc/https://joaquinbarroso.com/wp-content/uploads/2013/04/orbitals_hg.pngorbitals_hgHigher laying orbitals for Hg(II) complex2013-04-25T00:07:56+00:00monthlyhttps://joaquinbarroso.com/2013/04/23/realtimchem-day-2/https://joaquinbarroso.com/wp-content/uploads/2013/04/20130423-205119.jpg20130423-205119.jpghttps://joaquinbarroso.com/wp-content/uploads/2013/04/20130423-205058.jpg20130423-205058.jpgHard work pays off - We wait for you to come back for your Masters Degree!https://joaquinbarroso.com/wp-content/uploads/2013/04/20130423-204839.jpg20130423-204839.jpg2013-07-07T20:45:37+00:00monthlyhttps://joaquinbarroso.com/2013/04/23/realtimechem-1/https://joaquinbarroso.com/wp-content/uploads/2013/04/bifozwkcaaalkck.jpgDonald McQuarrie's quantum chemistryThe book is "Quantum Chemistry" by Donald McQuarriehttps://joaquinbarroso.com/wp-content/uploads/2013/04/9b8b7bdeab8a11e2af9022000a1f9a23_7.jpg9b8b7bdeab8a11e2af9022000a1f9a23_7The new anonymous intern launching his very first Gaussian calculation - awwhttps://joaquinbarroso.com/wp-content/uploads/2013/04/e5a285c2ab7c11e28df322000a9e48a8_7.jpge5a285c2ab7c11e28df322000a9e48a8_7Today's supporting info. +150 figures inserted into a Word file.2022-05-23T14:58:48+00:00monthlyhttps://joaquinbarroso.com/2013/04/15/realtimechem/2013-04-13T00:56:47+00:00monthlyhttps://joaquinbarroso.com/2013/03/28/webinar-gromacs/2013-03-28T16:51:54+00:00monthlyhttps://joaquinbarroso.com/2013/03/27/article-ciencia-y-desarrollo/2013-03-27T17:50:57+00:00monthlyhttps://joaquinbarroso.com/2013/03/06/nbo-chemcraft/2024-06-16T17:01:26+00:00monthlyhttps://joaquinbarroso.com/2009/06/01/pauling-hybridization-model/2013-02-28T15:12:14+00:00monthlyhttps://joaquinbarroso.com/2013/02/12/delta-g-of-solvation-in-gaussian09/2021-04-09T00:33:34+00:00monthlyhttps://joaquinbarroso.com/2012/12/20/1152/2012-12-21T16:16:28+00:00monthlyhttps://joaquinbarroso.com/links/2021-05-30T00:10:26+00:00weekly0.6https://joaquinbarroso.com/2012/11/15/xi-rmfqt/https://joaquinbarroso.com/wp-content/uploads/2012/11/poster-rmfqt.jpgposter rmfqt2014-09-30T22:39:38+00:00monthlyhttps://joaquinbarroso.com/2012/10/30/mexican-science-fair/https://joaquinbarroso.com/wp-content/uploads/2012/10/2012-10-29-12-49-47.jpg2012-10-29 12.49.47https://joaquinbarroso.com/wp-content/uploads/2012/10/2012-10-29-12-47-48.jpg2012-10-29 12.47.48https://joaquinbarroso.com/wp-content/uploads/2012/10/2012-10-29-11-30-05.jpg2012-10-29 11.30.05https://joaquinbarroso.com/wp-content/uploads/2012/10/2012-10-29-11-12-48.jpg2012-10-29 11.12.482012-10-30T14:42:40+00:00monthlyhttps://joaquinbarroso.com/2012/09/25/conacyt-funding-approved/2012-09-27T04:31:40+00:00monthlyhttps://joaquinbarroso.com/2010/10/28/nobel-prizes/2012-09-24T22:39:41+00:00monthlyhttps://joaquinbarroso.com/2011/06/03/haiduc/https://joaquinbarroso.com/wp-content/uploads/2011/06/int_year_chemistry_pantone_c1.pngInt_year_chemistry_Pantone_Chttps://joaquinbarroso.com/wp-content/uploads/2011/06/251285_10150214764340793_535765792_7358626_3455806_n.jpg251285_10150214764340793_535765792_7358626_3455806_nAt Teotihuacanhttps://joaquinbarroso.com/wp-content/uploads/2011/06/254295_10150214764425793_535765792_7358628_2832879_n-e1308265019836.jpg254295_10150214764425793_535765792_7358628_2832879_nAt the Anthropology Museum with the Aztec Calendar2012-09-24T22:37:03+00:00monthlyhttps://joaquinbarroso.com/2011/04/01/iqunam70/https://joaquinbarroso.com/wp-content/uploads/2011/04/instituto-t2.pnginstituto-t2Main entrance of the institute and current staff (well, most of it anyway)https://joaquinbarroso.com/wp-content/uploads/2011/04/luis_miramontes.jpgLuis_miramontesDr. Luis Miramonteshttps://joaquinbarroso.com/wp-content/uploads/2011/04/tera-ethyl-lead-chemical.pngTetraethyl-leadTetraethyllead - now toxic, this was an important component in gasoline as well as in other fuelshttps://joaquinbarroso.com/wp-content/uploads/2011/04/logo_70aniversario_iq.jpg70aniversario_IQ2012-09-24T22:32:43+00:00monthlyhttps://joaquinbarroso.com/2012/09/18/library-flood/https://joaquinbarroso.com/wp-content/uploads/2012/09/2012-09-17-18-19-08.jpg2012-09-17 18.19.08The announcement of grand things to comehttps://joaquinbarroso.com/wp-content/uploads/2012/09/2012-09-17-19-38-19.jpg2012-09-17 19.38.19An ancient iPad or an edgy Etch a Sketch?https://joaquinbarroso.com/wp-content/uploads/2012/09/2012-09-17-19-19-59.jpg2012-09-17 19.19.59Sir John Maddoxhttps://joaquinbarroso.com/wp-content/uploads/2012/09/2012-09-17-18-39-35.jpg2012-09-17 18.39.35Students as well as the academic and administrative staff drying journalshttps://joaquinbarroso.com/wp-content/uploads/2012/09/2012-09-17-18-26-48.jpg2012-09-17 18.26.48E-chesshttps://joaquinbarroso.com/wp-content/uploads/2012/09/2012-09-17-18-26-44.jpg2012-09-17 18.26.44An 80's sensation!https://joaquinbarroso.com/wp-content/uploads/2012/09/2012-09-17-18-24-27.jpg2012-09-17 18.24.27https://joaquinbarroso.com/wp-content/uploads/2012/09/2012-09-17-18-19-52.jpg2012-09-17 18.19.52Kudos to the library staff on organizing in promptu "Heal a book!"2012-09-24T22:30:47+00:00monthlyhttps://joaquinbarroso.com/2012/09/13/100000-visitors/https://joaquinbarroso.com/wp-content/uploads/2012/09/100000-1.png100,000-1100,012 visitors this morning. Thanks!2012-09-14T16:39:03+00:00monthlyhttps://joaquinbarroso.com/2012/08/06/the-local-bond-order/https://joaquinbarroso.com/wp-content/uploads/2012/08/imagen1.jpgequation1https://joaquinbarroso.com/wp-content/uploads/2012/08/imagen2.jpgequation2https://joaquinbarroso.com/wp-content/uploads/2012/08/imagen3.jpgequation32015-07-03T01:15:37+00:00monthlyhttps://joaquinbarroso.com/2012/07/27/polarizability-and-hyperpolarizability-in-gaussian/2025-10-14T00:14:55+00:00monthlyhttps://joaquinbarroso.com/2012/06/13/1027/2014-05-24T14:07:19+00:00monthlyhttps://joaquinbarroso.com/2012/06/06/ray-bradbury/https://joaquinbarroso.com/wp-content/uploads/2012/06/img_5630.jpgCrónicas Marcianas - Ray BradburyMy old copy of "Martian Chronicles" in Spanish bought in 1989. Thanks to my dad for taking this picture and using his ninja dropbox skills 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squarehttps://joaquinbarroso.com/wp-content/uploads/2009/10/cluj-napoca-joaquin-barroso-2.jpgCluj Napoca joaquin barroso 2Chemistry School; Babes-Bolyai Universityhttps://joaquinbarroso.com/wp-content/uploads/2009/10/cluj-napoca-joaquin-barroso-1.jpgCluj Napoca joaquin barroso 1Chios Central Park lake in the winter2024-11-03T21:19:27+00:00weekly0.6https://joaquinbarroso.com/2009/08/28/kentuckycomic/2010-02-06T11:36:27+00:00monthlyhttps://joaquinbarroso.com/2009/08/24/entropymess/2016-04-28T03:13:35+00:00monthlyhttps://joaquinbarroso.com/2009/07/27/theocompchem/2009-07-23T07:38:43+00:00monthlyhttps://joaquinbarroso.com/2009/05/07/science4all/2009-05-07T14:09:24+00:00monthlyhttps://joaquinbarroso.com/2009/04/29/flu-outbreak/2009-04-29T14:25:42+00:00monthlyhttps://joaquinbarroso.com/2009/03/11/density-functional-theory/2009-03-10T09:12:44+00:00monthlyhttps://joaquinbarroso.comdaily1.02026-03-28T05:28:59+00:00