Works matching IS 0920-654X AND VI 31 AND IP 6 AND DT 2017
Results: 6
Discovery of novel inhibitors for Leishmania nucleoside diphosphatase kinase (NDK) based on its structural and functional characterization.
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- Journal of Computer-Aided Molecular Design, 2017, v. 31, n. 6, p. 547, doi. 10.1007/s10822-017-0022-9
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- Article
MolAlign: an algorithm for aligning multiple small molecules.
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- Journal of Computer-Aided Molecular Design, 2017, v. 31, n. 6, p. 523, doi. 10.1007/s10822-017-0023-8
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- Article
Assessing protein-ligand binding modes with computational tools: the case of PDE4B.
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- Journal of Computer-Aided Molecular Design, 2017, v. 31, n. 6, p. 563, doi. 10.1007/s10822-017-0024-7
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- Article
Antagonist-perturbation mechanism for activation function-2 fixed motifs: active conformation and docking mode of retinoid X receptor antagonists.
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- Journal of Computer-Aided Molecular Design, 2017, v. 31, n. 6, p. 577, doi. 10.1007/s10822-017-0025-6
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- Article
DFT-based prediction of reactivity of short-chain alcohol dehydrogenase.
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- Journal of Computer-Aided Molecular Design, 2017, v. 31, n. 6, p. 587, doi. 10.1007/s10822-017-0026-5
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- Article
Structure based classification for bile salt export pump (BSEP) inhibitors using comparative structural modeling of human BSEP.
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- Journal of Computer-Aided Molecular Design, 2017, v. 31, n. 6, p. 507, doi. 10.1007/s10822-017-0021-x
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- Article