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Results:
1-12
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Results: 12
Authors:
Massova, I
Kollman, PA
Citation: I. Massova et Pa. Kollman, Combined molecular mechanical and continuum solvent approach (MM-PBSA/GBSA) to predict ligand binding, PERSP DR D, 18, 2000, pp. 113-135
Authors:
Lee, TS
Massova, I
Kuhn, B
Kollman, PA
Citation: Ts. Lee et al., QM and QM-FE simulations on reactions of relevance to enzyme catalysis: trypsin, catechol O-methyltransferase, beta-lactamase and pseudouridine synthase, J CHEM S P2, (3), 2000, pp. 409-415
Authors:
Olson, MW
Bernardo, MM
Pietila, M
Gervasi, DC
Toth, M
Kotra, LP
Massova, I
Mobashery, S
Fridman, R
Citation: Mw. Olson et al., Characterization of the monomeric and dimeric forms of latent and active matrix metalloproteinase-9 - Differential rates for activation by stromelysin 1, J BIOL CHEM, 275(4), 2000, pp. 2661-2668
Authors:
Golemi, D
Maveyraud, L
Ishiwata, A
Tranier, S
Miyashita, K
Nagase, T
Massova, I
Mourey, L
Samama, JP
Mobashery, S
Citation: D. Golemi et al., 6-(hydroxyalkyl)penicillanates as probes for mechanisms of beta-lactamases, J ANTIBIOT, 53(10), 2000, pp. 1022-1027
Authors:
Kollman, PA
Massova, I
Reyes, C
Kuhn, B
Huo, SH
Chong, L
Lee, M
Lee, T
Duan, Y
Wang, W
Donini, O
Cieplak, P
Srinivasan, J
Case, DA
Cheatham, TE
Citation: Pa. Kollman et al., Calculating structures and free energies of complex molecules: Combining molecular mechanics and continuum models, ACC CHEM RE, 33(12), 2000, pp. 889-897
Authors:
Massova, I
Kollman, PA
Citation: I. Massova et Pa. Kollman, Quantum mechanical study of beta-lactam reactivity: The effect of solvation on barriers of reaction and stability of transition states and reaction intermediates, J PHYS CH B, 103(40), 1999, pp. 8628-8638
Authors:
Massova, I
Mobashery, S
Citation: I. Massova et S. Mobashery, Structural and mechanistic aspects of evolution of beta-lactamases and penicillin-binding proteins, CUR PHARM D, 5(11), 1999, pp. 929-937
Authors:
Chong, LT
Duan, Y
Wang, L
Massova, I
Kollman, PA
Citation: Lt. Chong et al., Molecular dynamics and free-energy calculations applied to affinity maturation in antibody 48G7, P NAS US, 96(25), 1999, pp. 14330-14335
Authors:
Vakulenko, SB
Taibi-Tronche, P
Toth, M
Massova, I
Lerner, SA
Mobashery, S
Citation: Sb. Vakulenko et al., Effects on substrate profile by mutational substitutions at positions 164 and 179 of the class A TEMpUC19 beta-lactamase from Escherichia coli, J BIOL CHEM, 274(33), 1999, pp. 23052-23060
Authors:
Massova, I
Kollman, PA
Citation: I. Massova et Pa. Kollman, Computational alanine scanning to probe protein-protein interactions: A novel approach to evaluate binding free energies, J AM CHEM S, 121(36), 1999, pp. 8133-8143
Authors:
Swaren, P
Massova, I
Bellettini, JR
Bulychev, A
Maveyraud, L
Kotra, LP
Miller, MJ
Mobashery, S
Samama, JP
Citation: P. Swaren et al., Elucidation of mechanism of inhibition and x-ray structure of the TEM-1 beta-lactamase from Escherichia coli inhibited by a N-sulfonyloxy-beta-lactam, J AM CHEM S, 121(23), 1999, pp. 5353-5359
Authors:
Li, ZH
Bulychev, A
Kotra, LP
Massova, I
Mobashery, S
Citation: Zh. Li et al., Hydrogen bonding and attenuation of the rate of enzymic catalysis, J AM CHEM S, 120(50), 1998, pp. 13003-13007
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