Sanna P. Niinivehmas

发表

Rocker: Open source, easy-to-use tool for AUC and enrichment calculations and ROC visualization

Sakari Lätti, Olli T. Pentikäinen, Sanna P. Niinivehmas, 2016, Journal of Cheminformatics.

Ultrafast protein structure-based virtual screening with Panther

Kari Salokas, Hannu Raunio, Sakari Lätti, 2015, Journal of Computer-Aided Molecular Design.

Identification of estrogen receptor α ligands with virtual screening techniques.

Sanna P. Niinivehmas, E. Manivannan, O. Pentikäinen, 2016, Journal of molecular graphics & modelling.

Suitability of MMGBSA for the selection of correct ligand binding modes from docking results

Sanna P. Niinivehmas, O. Pentikäinen, Mira Ahinko, 2018, Chemical biology & drug design.

Sanna Niinivehmas Computational Studies of Biomolecular Screening and Interactions

Sanna P. Niinivehmas, 2015 .

Case-specific performance of MM-PBSA, MM-GBSA, and SIE in virtual screening.

Sanna P Niinivehmas, Olli T Pentikäinen, Salla I. Virtanen, 2015, Journal of molecular graphics & modelling.

Fragment‐ and negative image‐based screening of phosphodiesterase 10A inhibitors

Sanna P. Niinivehmas, Pekka A. Postila, O. Pentikäinen, 2019, Chemical biology & drug design.

Molecular Docking-Based Design and Development of a Highly Selective Probe Substrate for UDP-glucuronosyltransferase 1A10

Sanna P. Niinivehmas, M. Finel, O. Pentikäinen, 2018, Molecular pharmaceutics.

Structure-activity relationship of sphingomyelin analogs with sphingomyelinase from Bacillus cereus.

Sanna P. Niinivehmas, S. Katsumura, O. Pentikäinen, 2012, Biochimica et biophysica acta.

Discovery of Retinoic Acid-Related Orphan Receptor γt Inverse Agonists via Docking and Negative Image-Based Screening

Sanna P. Niinivehmas, Pekka A. Postila, K. Liedl, 2018, ACS omega.

Identification of the Privileged Position in the Imidazo[1,2-a]pyridine Ring of Phosphonocarboxylates for Development of Rab Geranylgeranyl Transferase (RGGT) Inhibitors.

Sanna P. Niinivehmas, A. Kaźmierczak, E. Gendaszewska-Darmach, 2017, Journal of medicinal chemistry.

Improving Docking Performance Using Negative Image-Based

Sami T Kurkinen, Sanna P. Niinivehmas, Pekka A. Postila, 2018 .

Coumarins as Tool Compounds to Aid the Discovery of Selective Function Modulators of Steroid Hormone Binding Proteins

Sanna P. Niinivehmas, O. Pentikäinen, 2021, Molecules.

Structure-Activity Relationship Analysis of 3-Phenylcoumarin-Based Monoamine Oxidase B Inhibitors

Sanna P. Niinivehmas, Pekka A. Postila, E. Manivannan, 2018, Front. Chem..

Molecular mechanism of T-cell protein tyrosine phosphatase (TCPTP) activation by mitoxantrone.

Sanna P. Niinivehmas, J. Määttä, J. Ivaska, 2013, Biochimica et biophysica acta.

Computational studies of biomolecular screening and interactions

Sanna Niinivehmas, Sanna P. Niinivehmas, 2015 .

A Practical Perspective: The Effect of Ligand Conformers on the Negative Image-Based Screening

Mira Ahinko, Sami T Kurkinen, Sanna P Niinivehmas, 2019, International journal of molecular sciences.

Rational design, optimization, and biological evaluation of novel α-Phosphonopropionic acids as covalent inhibitors of Rab geranylgeranyl transferase

Sanna P. Niinivehmas, E. Gendaszewska-Darmach, O. Pentikäinen, 2022, Journal of enzyme inhibition and medicinal chemistry.

2NH and 3OH are crucial structural requirements in sphingomyelin for sticholysin II binding and pore formation in bilayer membranes.

Sanna P. Niinivehmas, J. Gavilanes, S. Katsumura, 2013, Biochimica et biophysica acta.

Blocking oestradiol synthesis pathways with potent and selective coumarin derivatives

Sanna P. Niinivehmas, E. Manivannan, O. Pentikäinen, 2018, Journal of enzyme inhibition and medicinal chemistry.

Comparison of Virtual High-Throughput Screening Methods for the Identification of Phosphodiesterase-5 Inhibitors

Jukka V. Lehtonen, Salla I. Virtanen, Sanna P. Niinivehmas, 2011, J. Chem. Inf. Model..

Virtual Screening Strategy to Identify Retinoic Acid-Related Orphan Receptor γt Modulators

Jukka V. Lehtonen, Sanna P. Niinivehmas, Sami T. Kurkinen, 2023, Molecules.

Sdfconf: A Novel, Flexible, and Robust Molecular Data Management Tool

Sanna P. Niinivehmas, O. Pentikäinen, Sakari Lätti, 2021, J. Chem. Inf. Model..

Improving Docking Performance Using Negative Image-Based Rescoring

Mira Ahinko, Sanna Niinivehmas, Sakari Lätti, 2018, Front. Pharmacol..