Docking and scoring with ICM: the benchmarking results and strategies for improvement von Neves, Marco A. C., Totrov, Maxim, Abagyan, Ruben

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Anticancer steroids: linking natural and semi-synthetic compounds von Salvador, Jorge A R, Carvalho, João F S, Neves, Marco A C, Silvestre, Samuel M, Leitão, Alcino J, Silva, M Manuel C, Sá e Melo, M Luisa

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Unusual Arginine Formations in Protein Function and Assembly: Rings, Strings, and Stacks von Neves, Marco A. C, Yeager, Mark, Abagyan, Ruben

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Rational design of berberine-based FtsZ inhibitors with broad-spectrum antibacterial activity von Sun, Ning, Chan, Fung-Yi, Lu, Yu-Jing, Neves, Marco A C, Lui, Hok-Kiu, Wang, Yong, Chow, Ka-Yan, Chan, Kin-Fai, Yan, Siu-Cheong, Leung, Yun-Chung, Abagyan, Ruben, Chan, Tak-Hang, Wong, Kwok-Yin

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Identification of a New Class of FtsZ Inhibitors by Structure-Based Design and in Vitro Screening von Chan, Fung-Yi, Sun, Ning, Neves, Marco A. C, Lam, Polo Chun-Hung, Chung, Wai-Hong, Wong, Lai-King, Chow, Ho-Yin, Ma, Dik-Lung, Chan, Pak-Ho, Leung, Yun-Chung, Chan, Tak-Hang, Abagyan, Ruben, Wong, Kwok-Yin

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Dynamics-Based Discovery of Allosteric Inhibitors: Selection of New Ligands for the C-terminal Domain of Hsp90 von Morra, Giulia, Neves, Marco A. C, Plescia, Christopher J, Tsustsumi, Shinji, Neckers, Len, Verkhivker, Gennady, Altieri, Dario C, Colombo, Giorgio

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Fast Three Dimensional Pharmacophore Virtual Screening of New Potent Non-Steroid Aromatase Inhibitors von Neves, Marco A. C, Dinis, Teresa C. P, Colombo, Giorgio, Sá e Melo, M. Luisa

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An efficient steroid pharmacophore-based strategy to identify new aromatase inhibitors von Neves, Marco A.C., Dinis, Teresa C.P., Colombo, Giorgio, Sá e Melo, M. Luisa

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Ligand-guided optimization of CXCR4 homology models for virtual screening using a multiple chemotype approach von Neves, Marco A. C., Simões, Sérgio, Sá e Melo, M. Luisa

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Validation of the AmpC β-Lactamase Binding Site and Identification of Inhibitors with Novel Scaffolds von Chan, Fung-Yi, Neves, Marco A. C., Sun, Ning, Tsang, Man-Wah, Leung, Yun-Chung, Chan, Tak-Hang, Abagyan, Ruben, Wong, Kwok-Yin

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Combining Computational and Biochemical Studies for a Rationale on the Anti-Aromatase Activity of Natural Polyphenols von Neves, Marco A. C., Dinis, Teresa C. P., Colombo, Giorgio, Sá e Melo, M. Luisa

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Biochemical and computational insights into the anti-aromatase activity of natural catechol estrogens von Neves, Marco A.C., Dinis, Teresa C.P., Colombo, Giorgio, Luisa Sá e Melo, M.

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Salivary Markers Responses in the Post-Exercise and Recovery Period: A Systematic Review von Neves, Rafael Santos, da Silva, Marco Antônio Rabelo, de Rezende, Mônica A C, Caldo-Silva, Adriana, Pinheiro, João, Santos, Amândio M C

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Rationale, design, and baseline characteristics of the Acetylcystein for Contrast-Induced nephropaThy (ACT) Trial: a pragmatic randomized controlled trial to evaluate the efficacy...

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