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Items: 45

1.

Reorganization of Hydration Water of DPPC Multilamellar Vesicles Induced by l-Cysteine Interaction.

Arias JM, Tuttolomondo ME, Díaz SB, Ben Altabef A.

J Phys Chem B. 2018 May 24;122(20):5193-5204. doi: 10.1021/acs.jpcb.8b01721. Epub 2018 May 15.

PMID:
29717612
2.

FTIR spectroscopy of chronic venous leg ulcer exudates: an approach to spectral healing marker identification.

Cerusico N, Aybar JP, Lopez S, Molina SG, Chavez Jara R, Sesto Cabral ME, Valdez JC, Ben Altabef A, Ramos AN.

Analyst. 2018 Mar 26;143(7):1583-1592. doi: 10.1039/c7an01909b.

PMID:
29513326
3.

Characterization of interactions of eggPC lipid structures with different biomolecules.

Corrales Chahar F, Díaz SB, Ben Altabef A, Gervasi C, Alvarez PE.

Chem Phys Lipids. 2018 Jan;210:60-69. doi: 10.1016/j.chemphyslip.2017.11.013. Epub 2017 Nov 20.

PMID:
29158127
4.

A detailed exploration of intermolecular interactions in 4-(4-dimethylaminobenzylideneamino)-N-(5-methyl-3-isoxazolyl)benzenesulfonamide and related Schiff bases: Crystal structure, spectral studies, DFT methods, Pixel energies and Hirshfeld surface analysis.

Gil DM, Salomón FF, Echeverría GA, Piro OE, Pérez H, Altabef AB.

Spectrochim Acta A Mol Biomol Spectrosc. 2017 Oct 5;185:286-297. doi: 10.1016/j.saa.2017.05.066. Epub 2017 May 31.

PMID:
28595154
5.

Determination of the main solid-state form of albendazole in bulk drug, employing Raman spectroscopy coupled to multivariate analysis.

Calvo NL, Arias JM, Altabef AB, Maggio RM, Kaufman TS.

J Pharm Biomed Anal. 2016 Sep 10;129:190-197. doi: 10.1016/j.jpba.2016.07.013. Epub 2016 Jul 10.

PMID:
27429368
6.

STK11/LKB1 Deficiency Promotes Neutrophil Recruitment and Proinflammatory Cytokine Production to Suppress T-cell Activity in the Lung Tumor Microenvironment.

Koyama S, Akbay EA, Li YY, Aref AR, Skoulidis F, Herter-Sprie GS, Buczkowski KA, Liu Y, Awad MM, Denning WL, Diao L, Wang J, Parra-Cuentas ER, Wistuba II, Soucheray M, Thai T, Asahina H, Kitajima S, Altabef A, Cavanaugh JD, Rhee K, Gao P, Zhang H, Fecci PE, Shimamura T, Hellmann MD, Heymach JV, Hodi FS, Freeman GJ, Barbie DA, Dranoff G, Hammerman PS, Wong KK.

Cancer Res. 2016 Mar 1;76(5):999-1008. doi: 10.1158/0008-5472.CAN-15-1439. Epub 2016 Feb 1.

7.

Gas-phase structure of 2,2,2-trichloroethyl chloroformate studied by electron diffraction and quantum-chemical calculations.

Gil DM, Tuttolomondo ME, Blomeyer S, Reuter CG, Mitzel NW, Altabef AB.

Phys Chem Chem Phys. 2016 Jan 7;18(1):393-402. doi: 10.1039/c5cp05295e. Epub 2015 Nov 30.

PMID:
26617390
8.

Molecular view of the interaction of S-methyl methanethiosulfonate with DPPC bilayer.

Miguel V, Defonsi Lestard ME, Tuttolomondo ME, Díaz SB, Altabef AB, Puiatti M, Pierini AB.

Biochim Biophys Acta. 2016 Jan;1858(1):38-46. doi: 10.1016/j.bbamem.2015.10.008. Epub 2015 Oct 23.

9.

Antifungal activity of 4-hydroxy-3-(3-methyl-2-butenyl)acetophenone against Candida albicans: evidence for the antifungal mode of action.

Soberón JR, Lizarraga EF, Sgariglia MA, Carrasco Juárez MB, Sampietro DA, Ben Altabef A, Catalán CA, Vattuone MA.

Antonie Van Leeuwenhoek. 2015 Nov;108(5):1047-57. doi: 10.1007/s10482-015-0559-3. Epub 2015 Sep 5.

PMID:
26342699
10.

Vibrational studies (FTIR and Raman), conformational analysis, NBO, HOMO-LUMO and reactivity descriptors of S-methyl thiobutanoate, CH3CH2CH2C(O)SCH3.

Gil DM, Tuttolomondo ME, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2015;149:408-18. doi: 10.1016/j.saa.2015.04.097. Epub 2015 May 2.

PMID:
25974674
11.

Targeting transcriptional addictions in small cell lung cancer with a covalent CDK7 inhibitor.

Christensen CL, Kwiatkowski N, Abraham BJ, Carretero J, Al-Shahrour F, Zhang T, Chipumuro E, Herter-Sprie GS, Akbay EA, Altabef A, Zhang J, Shimamura T, Capelletti M, Reibel JB, Cavanaugh JD, Gao P, Liu Y, Michaelsen SR, Poulsen HS, Aref AR, Barbie DA, Bradner JE, George RE, Gray NS, Young RA, Wong KK.

Cancer Cell. 2014 Dec 8;26(6):909-922. doi: 10.1016/j.ccell.2014.10.019. Erratum in: Cancer Cell. 2015 Jan 12;27(1):149.

12.

Ab-initio and DFT calculations on molecular structure, NBO, HOMO-LUMO study and a new vibrational analysis of 4-(Dimethylamino) Benzaldehyde.

Rocha M, Di Santo A, Arias JM, Gil DM, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2015 Feb 5;136 Pt B:635-43. doi: 10.1016/j.saa.2014.09.077. Epub 2014 Sep 30.

PMID:
25448963
13.

CDK7 inhibition suppresses super-enhancer-linked oncogenic transcription in MYCN-driven cancer.

Chipumuro E, Marco E, Christensen CL, Kwiatkowski N, Zhang T, Hatheway CM, Abraham BJ, Sharma B, Yeung C, Altabef A, Perez-Atayde A, Wong KK, Yuan GC, Gray NS, Young RA, George RE.

Cell. 2014 Nov 20;159(5):1126-1139. doi: 10.1016/j.cell.2014.10.024. Epub 2014 Nov 6.

14.

Vibrational spectroscopy and conformation of S-ethyl thioacetate: CH3COSCH2CH3 and comparison with -C(O)S- and -C(O)O- compounds.

Defonsi Lestard ME, Tuttolomondo ME, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2015 Jan 25;135:907-14. doi: 10.1016/j.saa.2014.07.054. Epub 2014 Aug 7.

PMID:
25155947
15.

Kinase domain activation of FGFR2 yields high-grade lung adenocarcinoma sensitive to a Pan-FGFR inhibitor in a mouse model of NSCLC.

Tchaicha JH, Akbay EA, Altabef A, Mikse OR, Kikuchi E, Rhee K, Liao RG, Bronson RT, Sholl LM, Meyerson M, Hammerman PS, Wong KK.

Cancer Res. 2014 Sep 1;74(17):4676-84. doi: 10.1158/0008-5472.CAN-13-3218. Epub 2014 Jul 17.

16.

Loss of Lkb1 and Pten leads to lung squamous cell carcinoma with elevated PD-L1 expression.

Xu C, Fillmore CM, Koyama S, Wu H, Zhao Y, Chen Z, Herter-Sprie GS, Akbay EA, Tchaicha JH, Altabef A, Reibel JB, Walton Z, Ji H, Watanabe H, Jänne PA, Castrillon DH, Rustgi AK, Bass AJ, Freeman GJ, Padera RF, Dranoff G, Hammerman PS, Kim CF, Wong KK.

Cancer Cell. 2014 May 12;25(5):590-604. doi: 10.1016/j.ccr.2014.03.033. Epub 2014 May 1.

17.

Synthesis, crystal structure, conformational and vibrational properties of 6-acetyl-2,2-dimethyl-chromane.

Lizarraga E, Gil DM, Echeverría GA, Piro OE, Catalán CA, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2014 Jun 5;127:74-84. doi: 10.1016/j.saa.2014.02.035. Epub 2014 Feb 24.

PMID:
24632159
18.

DFT calculations of structure and vibrational properties of 2,2,2-trichloroethylacetate, CH(3)CO(2)CH(2)CCl(3).

Gil DM, Tuttolomondo ME, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2014 Apr 5;123:290-7. doi: 10.1016/j.saa.2013.12.042. Epub 2013 Dec 17.

PMID:
24407197
19.

Vibrational and structural behavior of (L)-cysteine ethyl ester hydrochloride in the solid state and in aqueous solution.

Defonsi Lestard ME, Díaz SB, Puiatti M, Echeverría GA, Piro OE, Pierini AB, Altabef AB, Tuttolomondo ME.

J Phys Chem A. 2013 Dec 27;117(51):14243-52. doi: 10.1021/jp409252d. Epub 2013 Dec 16.

PMID:
24328050
20.

Co-clinical trials demonstrate superiority of crizotinib to chemotherapy in ALK-rearranged non-small cell lung cancer and predict strategies to overcome resistance.

Chen Z, Akbay E, Mikse O, Tupper T, Cheng K, Wang Y, Tan X, Altabef A, Woo SA, Chen L, Reibel JB, Janne PA, Sharpless NE, Engelman JA, Shapiro GI, Kung AL, Wong KK.

Clin Cancer Res. 2014 Mar 1;20(5):1204-1211. doi: 10.1158/1078-0432.CCR-13-1733. Epub 2013 Dec 10.

21.

Activation of the PD-1 pathway contributes to immune escape in EGFR-driven lung tumors.

Akbay EA, Koyama S, Carretero J, Altabef A, Tchaicha JH, Christensen CL, Mikse OR, Cherniack AD, Beauchamp EM, Pugh TJ, Wilkerson MD, Fecci PE, Butaney M, Reibel JB, Soucheray M, Cohoon TJ, Janne PA, Meyerson M, Hayes DN, Shapiro GI, Shimamura T, Sholl LM, Rodig SJ, Freeman GJ, Hammerman PS, Dranoff G, Wong KK.

Cancer Discov. 2013 Dec;3(12):1355-63. doi: 10.1158/2159-8290.CD-13-0310. Epub 2013 Sep 27.

22.

Layered crystal structure, conformational and vibrational properties of 2,2,2-trichloroethoxysulfonamide: an experimental and theoretical study.

Gil DM, Piro OE, Echeverría GA, Tuttolomondo ME, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2013 Dec;116:122-31. doi: 10.1016/j.saa.2013.07.013. Epub 2013 Jul 18.

PMID:
23917382
23.

Metabolic and functional genomic studies identify deoxythymidylate kinase as a target in LKB1-mutant lung cancer.

Liu Y, Marks K, Cowley GS, Carretero J, Liu Q, Nieland TJ, Xu C, Cohoon TJ, Gao P, Zhang Y, Chen Z, Altabef AB, Tchaicha JH, Wang X, Choe S, Driggers EM, Zhang J, Bailey ST, Sharpless NE, Hayes DN, Patel NM, Janne PA, Bardeesy N, Engelman JA, Manning BD, Shaw RJ, Asara JM, Scully R, Kimmelman A, Byers LA, Gibbons DL, Wistuba II, Heymach JV, Kwiatkowski DJ, Kim WY, Kung AL, Gray NS, Root DE, Cantley LC, Wong KK.

Cancer Discov. 2013 Aug;3(8):870-9. doi: 10.1158/2159-8290.CD-13-0015. Epub 2013 May 28.

24.

Characterization of Torin2, an ATP-competitive inhibitor of mTOR, ATM, and ATR.

Liu Q, Xu C, Kirubakaran S, Zhang X, Hur W, Liu Y, Kwiatkowski NP, Wang J, Westover KD, Gao P, Ercan D, Niepel M, Thoreen CC, Kang SA, Patricelli MP, Wang Y, Tupper T, Altabef A, Kawamura H, Held KD, Chou DM, Elledge SJ, Janne PA, Wong KK, Sabatini DM, Gray NS.

Cancer Res. 2013 Apr 15;73(8):2574-86. doi: 10.1158/0008-5472.CAN-12-1702. Epub 2013 Feb 22.

25.

Insecticidal properties of annonaceous acetogenins and their analogues. Interaction with lipid membranes.

Blessing LD, Ramos J, Diaz S, Ben Altabef A, Bardón A, Brovetto M, Seoane G, Neske A.

Nat Prod Commun. 2012 Sep;7(9):1215-8.

PMID:
23074912
26.

Interaction of S-methyl methanethiosulfonate with DPPC bilayer.

Defonsi Lestard ME, Díaz SB, Tuttolomondo ME, Sánchez Cortez S, Puiatti M, Pierini AB, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2012 Nov;97:479-89. doi: 10.1016/j.saa.2012.06.045. Epub 2012 Jul 3.

PMID:
22832011
27.

Bis (trifluoromethyl) sulfone, CF3SO2CF3: synthesis, vibrational and conformational properties.

Defonsi Lestard ME, Ramos LA, Tuttolomondo ME, Ulic SE, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2012 Oct;96:332-9. doi: 10.1016/j.saa.2012.05.049. Epub 2012 May 26.

PMID:
22706098
28.

A murine lung cancer co-clinical trial identifies genetic modifiers of therapeutic response.

Chen Z, Cheng K, Walton Z, Wang Y, Ebi H, Shimamura T, Liu Y, Tupper T, Ouyang J, Li J, Gao P, Woo MS, Xu C, Yanagita M, Altabef A, Wang S, Lee C, Nakada Y, Peña CG, Sun Y, Franchetti Y, Yao C, Saur A, Cameron MD, Nishino M, Hayes DN, Wilkerson MD, Roberts PJ, Lee CB, Bardeesy N, Butaney M, Chirieac LR, Costa DB, Jackman D, Sharpless NE, Castrillon DH, Demetri GD, Jänne PA, Pandolfi PP, Cantley LC, Kung AL, Engelman JA, Wong KK.

Nature. 2012 Mar 18;483(7391):613-7. doi: 10.1038/nature10937.

29.

Structural and vibrational analysis of thymoquinone.

Raschi AB, Romano E, Benavente AM, Ben Altabef A, Tuttolomondo ME.

Spectrochim Acta A Mol Biomol Spectrosc. 2010 Oct 1;77(2):497-505. doi: 10.1016/j.saa.2010.06.026. Epub 2010 Jun 23.

PMID:
20634122
30.

Theoretical and experimental vibrational spectrum study of 4-hydroxybenzoic acid as monomer and dimer.

Brandán SA, Márquez López F, Montejo M, López González JJ, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2010 May;75(5):1422-34. doi: 10.1016/j.saa.2010.01.012. Epub 2010 Feb 6.

PMID:
20223703
31.

A conformational and vibrational study of CF(3)COSCH(2)CH(3).

Lestard ME, Tuttolomondo ME, Wann DA, Robertson HE, Rankin DW, Ben Altabef A.

J Chem Phys. 2009 Dec 7;131(21):214303. doi: 10.1063/1.3267633.

PMID:
19968344
32.

Conformational and vibrational analysis of methyl methanesulfonate, CH3SO2OCH3.

Tuttolomondo ME, Navarro A, Peña T, Varetti EL, Parker SF, Ben Altabef A.

J Phys Chem A. 2009 Jul 23;113(29):8401-8. doi: 10.1021/jp902993p.

PMID:
19569677
33.

Combined experimental studies and theoretical calculations to yield the complete molecular structure and vibrational spectra of (CH3)3GeH.

Roldán ML, Brandán SA, Masters Née Hinchley SL, Wann DA, Robertson HE, Rankin DW, Altabef AB.

J Phys Chem A. 2009 Apr 30;113(17):5195-204. doi: 10.1021/jp810988s.

PMID:
19298067
34.

Gas-phase structure, rotational barrier, and vibrational properties of methyl methanethiosulfonate, CH3SO2SCH3: an experimental and computational study.

Tuttolomondo ME, Navarro A, Ruiz TP, Varetti EL, Hayes SA, Wann DA, Robertson HE, Rankin DW, Altabef AB.

J Phys Chem A. 2007 Oct 4;111(39):9952-60. Epub 2007 Aug 31.

PMID:
17760430
35.

DFT calculation of the chromyl nitrate, CrO2(NO3)2 The molecular force field.

Brandán SA, Roldán ML, Socolsky C, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2008 Mar;69(3):1027-43. Epub 2007 Jun 23.

PMID:
17669684
36.

Molecular structure and vibrational spectra of iodotrimethylgermane (GeIMe3) by theory and experiment.

Roldán ML, Brandán SA, Masters SL, Wann DA, Robertson HE, Rankin DW, Ben Altabef A.

J Phys Chem A. 2007 Aug 2;111(30):7200-10. Epub 2007 Jul 12.

PMID:
17628053
37.

FTIR analysis of the interaction of arbutin with dimyristoyl phosphatidylcholine in anhydrous and hydrated states.

Frías MA, Díaz SB, Ale NM, Ben Altabef A, Disalvo EA.

Biochim Biophys Acta. 2006 Nov;1758(11):1823-9. Epub 2006 Jul 20.

38.

Hydration of inorganic phosphates in crystal lattices and in aqueous solution. An experimental and theoretical study.

Brandán SA, Díaz SB, Picot RC, Disalvo EA, Altabef AB.

Spectrochim Acta A Mol Biomol Spectrosc. 2007 Apr;66(4-5):1152-64. Epub 2006 Jun 6.

PMID:
16843715
39.

Experimental and theoretical study of the hydration of phosphate groups in esters of biological interest.

Brandán SA, Díaz SB, López González JJ, Disalvo EA, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2007 Apr;66(4-5):884-97. Epub 2006 May 10.

PMID:
16843704
40.

Theoretical structure and vibrational analysis of ethyl methanesulfonate, CH3SO2OCH2CH3.

Tuttolomondo ME, Navarro A, Peña T, Varetti EL, Altabef AB.

J Phys Chem A. 2005 Sep 8;109(35):7946-56.

PMID:
16834177
41.

An experimental and theoretical study of the molecular structure and vibrational spectra of iodotrimethylsilane (SiIMe3).

Montejo M, Hinchley SL, Altabef AB, Robertson HE, Ureña FP, Rankin DW, López González JJ.

Phys Chem Chem Phys. 2006 Jan 28;8(4):477-85. Epub 2005 Nov 8.

PMID:
16482290
42.

Infrared and Raman spectra and quantum chemistry calculations for 2,2,2-trifluoroethyl trichloromethanesulfonate, CCl3SO2OCH2CF3.

Tuttolomondo ME, Navarro A, Varetti EL, Ben Altabef A.

Spectrochim Acta A Mol Biomol Spectrosc. 2005 Mar;61(5):1011-9.

PMID:
15683811
43.

Experimental and theoretical vibrational study of 2,2,2-trifluoroethyl trifluoromethanesulfonate, CF3SO2OCH2CF3.

Tuttolomondo ME, Fernández LE, Navarro A, Varetti EL, Altabef AB.

Spectrochim Acta A Mol Biomol Spectrosc. 2004 Feb;60(3):611-9.

PMID:
14747086
44.

Infrared and Raman spectra and theoretical study of methyl trifluoromethyl sulfone, CF3SO2CH3.

Fernández LE, Altabef AB, Fantoni AC, Varetti EL.

Spectrochim Acta A Mol Biomol Spectrosc. 2000 Nov 1;56A(12):2379-89.

PMID:
11075678
45.

Experimental and theoretical vibrational study of silyl trifluoromethanesulfonate, CF3SO2OSiH3.

Fernández LE, Altabef AB, Navarro A, Fernández Gómez M, Varetti EL.

Spectrochim Acta A Mol Biomol Spectrosc. 2000 May;56(6):1101-10.

PMID:
10845538

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