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2010

MoDEL (Molecular Dynamics Extended Library): a database of atomistic molecular dynamics trajectories.

Structure (London, England : 1993)

T. Meyer, M. D'Abramo, A. Hospital, M. Rueda, C. Ferrer-Costa, A. Pérez, O. Carrillo, J. Camps, C. Fenollosa, D. Repchevsky, J L. Gelpí, and M. Orozco
MoDEL (Molecular Dynamics Extended Library). A database of atomistic molecular dynamics simulations

T. Meyer, M. D'Abramo, A. Hospital, M. Rueda, C. Ferrer-Costa, A. Pérez, O. Carrillo, C. Fenollosa, D. Perchevsky, J L. Gelpí, and M. Orozco
Enabling HMMER for the Grid with COMP Superscalar

Proceedings of the International Conference on Computational Science 2010

E. Tejedor, R. M. Badia, R. Royo, and J L. Gelpí

2009

FlexServ: an integrated tool for the analysis of protein flexibility.

Bioinformatics (Oxford, England)

J. Camps, O. Carrillo, A. Emperador, L. Orellana, A. Hospital, M. Rueda, D. Cicin-Sain, M. D'Abramo, J L. Gelpí, and M. Orozco
Thienylhalomethylketones: Irreversible glycogen synthase kinase 3 inhibitors as useful pharmacological tools.

Bioorganic & medicinal chemistry

D. I. Perez, S. Conde, C. Pérez, C. Gil, D. Simon, F. Wandosell, F. J. Moreno, J L. Gelpí, F J. Luque, and A. Martínez
Role of Pre-A motif in nitric oxide scavenging by truncated hemoglobin, HbN, of Mycobacterium tuberculosis.

The Journal of biological chemistry

A. Lama, S. Pawaria, A. Bidon-Chanal, A. Anand, J L. Gelpí, S. Arya, M. Martí, D. A. Estrin, F J. Luque, and K. L. Dikshit
Synthesis, structural analysis, and biological evaluation of thioxoquinazoline derivatives as phosphodiesterase 7 inhibitors.

ChemMedChem

T. Castaño, H. Wang, N. E. Campillo, S. Ballester, C. González-García, J. Hernández, C. Pérez, J. Cuenca, A. Pérez-Castillo, A. Martínez, O. Huertas, J L. Gelpí, F J. Luque, H. Ke, and C. Gil
Thienylhalomethylketones: irreversible glycogen synthase kinase 3 inhibitors as useful pharmacological tools

D. I. Perez, S. Conde, C. Pérez, C. Gil, D. Simon, F. Wandosell, F. J. Moreno, J L. Gelpí, F J. Luque, and A. Martínez
FlexServ: An integrated tool for the analysis of protein flexibility

J. Camps, O. Carrillo, A. Emperador, L. Orellana, A. Hospital, M. Rueda, D. Cicin, M. D'Abramo, J L. Gelpí, and M. Orozco

2007

Dissection of the Recognition Properties of p38 MAP Kinase. Determination of the Binding Mode of a New Pyridinyl−Heterocycle Inhibitor Family

Journal of Medicinal Chemistry

R. Soliva, J L. Gelpí, C. Almansa, M. Virgili, and M. Orozco

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