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Conformational Sampling Deciphers the Chameleonic Properties of a VHL-Based Degrader.
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- Pharmaceutics, 2023, v. 15, n. 1, p. 272, doi. 10.3390/pharmaceutics15010272
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- Article
IκBα targeting promotes oxidative stress-dependent cell death.
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- Journal of Experimental & Clinical Cancer Research (17569966), 2021, v. 40, n. 1, p. 1, doi. 10.1186/s13046-021-01921-x
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- Article
Unsymmetrically substituted furoxans. Part 16.
- Published in:
- Journal of Heterocyclic Chemistry, 1996, v. 33, n. 2, p. 327, doi. 10.1002/jhet.5570330220
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- Article
Characterization of the Channel Constriction Allowing the Access of the Substrate to the Active Site of Yeast Oxidosqualene Cyclase.
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- PLoS ONE, 2011, v. 6, n. 7, p. 1, doi. 10.1371/journal.pone.0022134
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- Article
Molecular-Dynamics and NMR Investigation of the Property Space of the Zwitterionic Antihistamine Cetirizine.
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- Helvetica Chimica Acta, 2001, v. 84, n. 2, p. 360, doi. 10.1002/1522-2675(20010228)84:2<360::AID-HLCA360>3.0.CO;2-S
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- Article
Ionic Partition Diagram of the Zwitterionic Antihistamine Cetirizine.
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- Helvetica Chimica Acta, 2001, v. 84, n. 2, p. 375, doi. 10.1002/1522-2675(20010228)84:2<375::AID-HLCA375>3.0.CO;2-4
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- Article
Structure-Property Relationships in the Basicity and Lipophilicity of Arylalkylamine Oxides.
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- Helvetica Chimica Acta, 1999, v. 82, n. 10, p. 1630, doi. 10.1002/(SICI)1522-2675(19991006)82:10<1630::AID-HLCA1630>3.0.CO;2-P
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- Article
Synthesis and Structural Characterization of the Trimeric Furoxan (= Furazan 2-Oxide) System, a New Potent Vasodilating Moiety.
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- Helvetica Chimica Acta, 1996, v. 79, n. 7, p. 1803, doi. 10.1002/hlca.19960790706
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- Article
MLR, PLSR-BR Analysis and MBPLSR to Interpret Multivariate QSPR Models. The Case of a Micellar Liquid Chromatography Descriptor (log K<sub>W</sub><sup>SDS</sup>).
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- Molecular Informatics, 2019, v. 38, n. 8/9, p. 1, doi. 10.1002/minf.201800144
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- Article
In Silico Tools to Extract the Drug Design Information Content of Degradation Data: The Case of PROTACs Targeting the Androgen Receptor.
- Published in:
- Molecules, 2023, v. 28, n. 3, p. 1206, doi. 10.3390/molecules28031206
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- Article
Personalized Treatment for Infantile Ascending Hereditary Spastic Paralysis Based on In Silico Strategies.
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- Molecules, 2022, v. 27, n. 20, p. 7063, doi. 10.3390/molecules27207063
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- Article
Author Correction: Modeling ErbB2-p130Cas interaction to design new potential anticancer agents.
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- 2019
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- Correction Notice
Intramolecular hydrogen bonding: An opportunity for improved design in medicinal chemistry.
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- Medicinal Research Reviews, 2019, v. 39, n. 5, p. 1707, doi. 10.1002/med.21562
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- Article
Prediction and interpretation of the lipophilicity of small peptides.
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- Journal of Computer-Aided Molecular Design, 2015, v. 29, n. 4, p. 361, doi. 10.1007/s10822-015-9829-4
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- Article
OpenCDLig: a free web application for sharing resources about cyclodextrin/ligand complexes.
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- Journal of Computer-Aided Molecular Design, 2009, v. 23, n. 9, p. 669, doi. 10.1007/s10822-009-9290-3
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- Article
Docking studies on NSAID/COX-2 isozyme complexes using Contact Statistics analysis.
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- Journal of Computer-Aided Molecular Design, 2004, v. 18, n. 11, p. 683, doi. 10.1007/s10822-004-6258-1
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- Article
Managing Experimental 3D Structures in the Beyond‐Rule‐of‐5 Chemical Space: The Case of Rifampicin.
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- Chemistry - A European Journal, 2021, v. 27, n. 40, p. 10394, doi. 10.1002/chem.202100961
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- Article
PROTACs and Building Blocks: The 2D Chemical Space in Very Early Drug Discovery.
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- Molecules, 2021, v. 26, n. 3, p. 672, doi. 10.3390/molecules26030672
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- Article
Modeling ErbB2-p130Cas interaction to design new potential anticancer agents.
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- Scientific Reports, 2019, v. 9, n. 1, p. 1, doi. 10.1038/s41598-019-39510-w
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- Article
The Relevance of Polar Surface Area (PSA) in Rationalizing Biological Properties of Several cis-Diamminemalonatoplatinum(II) Derivatives.
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- ChemMedChem, 2009, v. 4, n. 10, p. 1677, doi. 10.1002/cmdc.200900224
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- Article
How to Extend the Use of Grid-Based Interaction Energy Maps from Chemistry to Biotopics.
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- ChemMedChem, 2009, v. 4, n. 1, p. 29, doi. 10.1002/cmdc.200800259
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- Article
Molecular and statistical modeling of reduction peak potential and lipophilicity of platinum(IV) complexes.
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- Journal of Biological Inorganic Chemistry (JBIC), 2011, v. 16, n. 3, p. 361, doi. 10.1007/s00775-010-0731-1
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- Article
Molecular Interaction Fields (MIFs) to Predict Lipophilicity and ADME Profile of Antitumor Pt(II) Complexes.
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- Pharmaceutical Research, 2011, v. 28, n. 3, p. 640, doi. 10.1007/s11095-010-0317-1
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- Article
Predicting the Oxidative Metabolism of Statins: An Application of the MetaSite® Algorithm.
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- Pharmaceutical Research, 2007, v. 24, n. 3, p. 480, doi. 10.1007/s11095-006-9199-7
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- Article