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Carlos Sosa
Carlos Sosa
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A local density functional study of the structure and vibrational frequencies of molecular transition-metal compounds
C Sosa, J Andzelm, BC Elkin, E Wimmer, KD Dobbs, DA Dixon
The Journal of Physical Chemistry 96 (16), 6630-6636, 1992
8891992
Evaluation of the density functional approximation on the computation of hydrogen bond interactions
JJ Novoa, C Sosa
The Journal of Physical Chemistry 99 (43), 15837-15845, 1995
3581995
Multilevel parallelization of AutoDock 4.2
AP Norgan, PK Coffman, JPA Kocher, DJ Katzmann, CP Sosa
Journal of cheminformatics 3, 1-9, 2011
2072011
A theoretical study of the ionic dissociation of HF, HCl, and H2S in water clusters
C Lee, C Sosa, M Planas, JJ Novoa
The Journal of chemical physics 104 (18), 7081-7085, 1996
1671996
Ab initio calculations on the barrier height for the hydrogen addition to ethylene and formaldehyde. The importance of spin projection
C Sosa, H Bernhard Schlegel
International Journal of Quantum Chemistry 29 (4), 1001-1015, 1986
1601986
Theory and implementation of the MBPT density matrix. An application to one-electron properties
GW Trucks, EA Salter, C Sosa, RJ Bartlett
Chemical physics letters 147 (4), 359-366, 1988
1541988
Density functional description of transition structures using nonlocal corrections. Silylene insertion reactions into the hydrogen molecule
C Sosa, C Lee
The Journal of chemical physics 98 (10), 8004-8011, 1993
1381993
Calculated barrier heights for OH+ C2H2 and OH+ C2H4 using unrestricted Moeller-Plesset perturbation theory with spin annihilation
C Sosa, HB Schlegel
Journal of the American Chemical Society 109 (14), 4193-4198, 1987
1311987
Ab initio study of the addition reaction of the methyl radical to ethylene and formaldehyde
C Gonzalez, C Sosa, HB Schlegel
The Journal of Physical Chemistry 93 (6), 2435-2440, 1989
1241989
Fullerene derivatives. Comparative theoretical study of C60O and C60CH2
K Raghavachari, C Sosa
Chemical physics letters 209 (3), 223-228, 1993
1191993
Neoantigenic potential of complex chromosomal rearrangements in mesothelioma
AS Mansfield, T Peikert, JB Smadbeck, JBM Udell, E Garcia-Rivera, ...
Journal of Thoracic Oncology 14 (2), 276-287, 2019
1112019
Theoretical study of the mechanism of recombinative hydrogen desorption from the monohydride phase of Si (100): The role of defect migration
P Nachtigall, KD Jordan, C Sosa
The Journal of chemical physics 101 (9), 8073-8081, 1994
1071994
Selection of the reduced virtual space for correlated calculations. An application to the energy and dipole moment of H2O
C Sosa, J Geertsen, GW Trucks, RJ Bartlett, JA Franz
Chemical physics letters 159 (2-3), 148-154, 1989
1071989
IBM system Blue Gene solution
C Sosa
IBM, International Technical Support Organization, 2008
1022008
Theoretical study of chemical reactions using density functional methods with nonlocal corrections
J Andzelm, C Sosa, RA Eades
The Journal of Physical Chemistry 97 (18), 4664-4669, 1993
941993
An ab initio study of the reaction pathways for OH+ C2H4. fwdarw. HOCH2CH2. fwdarw. products
C Sosa, HB Schlegel
Journal of the American Chemical Society 109 (23), 7007-7015, 1987
901987
Carbene and silylene insertion reactions. Ab initio calculations on the effects of fluorine substitution
C Sosa, HB Schlegel
Journal of the American Chemical Society 106 (20), 5847-5852, 1984
901984
YAP tyrosine phosphorylation and nuclear localization in cholangiocarcinoma cells are regulated by LCK and independent of LATS activity
T Sugihara, NW Werneburg, MC Hernandez, L Yang, A Kabashima, ...
Molecular Cancer Research 16 (10), 1556-1567, 2018
862018
A study of the Be2 potential curve using the full (CCSDT) coupled‐cluster method: The importance of T4 clusters
C Sosa, J Noga, RJ Bartlett
The Journal of chemical physics 88 (9), 5974-5976, 1988
821988
Massively parallel genomic sequence search on the Blue Gene/P architecture
H Lin, P Balaji, R Poole, C Sosa, X Ma, W Feng
SC'08: Proceedings of the 2008 ACM/IEEE Conference on Supercomputing, 1-11, 2008
772008
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Articles 1–20