UB Paderborn / Katalog / Suche / in CDI

Sortiert nach

Einfacher Volltextzugriff von (fast) überall

Installieren Sie die LibKey Nomad-Browsererweiterung und erhalten Sie von vielen Webseiten einfachen Zugriff auf lizenzierte Volltexte oder Open Access Publikationen. Mehr erfahren...

ePharmer: An integrated and graphical software for pharmacophore‐based virtual screening

Journal of computational chemistry, 2021-11, Vol.42 (30), p.2181-2195

2021

Volltextzugriff (PDF)

Structure‐based pharmacophore modeling, virtual screening approaches to identifying the potent hepatitis C viral protease and polymerase novel inhibitors

Journal of cellular biochemistry, 2022-08, Vol.123 (8), p.1366-1380

2022

Volltextzugriff (PDF)

Fragment-based discovery of new potential DNMT1 inhibitors integrating multiple pharmacophore modeling, 3D-QSAR, virtual screening, molecular docking, ADME, and molecular dynamics simulation approaches

Molecular diversity, 2024-04

2024

Volltextzugriff (PDF)

Identification of natural compound inhibitors against PfDXR: A hybrid structure‐based molecular modeling approach and molecular dynamics simulation studies

Journal of cellular biochemistry, 2019-09, Vol.120 (9), p.14531-14543

2019

Volltextzugriff (PDF)

Drug Design by Pharmacophore and Virtual Screening Approach

Pharmaceuticals (Basel, Switzerland), 2022-05, Vol.15 (5), p.646

2022

Volltextzugriff (PDF)

Pharmacophore development, drug-likeness analysis, molecular docking, and molecular dynamics simulations for identification of new CK2 inhibitors

Journal of molecular modeling, 2020-05, Vol.26 (6), p.160, Article 160

2020

Volltextzugriff (PDF)

Identification of new small molecules as dual FoxM1 and Hsp70 inhibitors using computational methods

Research in pharmaceutical sciences, 2022-11, Vol.17 (6), p.635-656

2022

Volltextzugriff (PDF)

First universal pharmacophore model for hERG1 K+ channel activators: acthER

Journal of molecular graphics & modelling, 2017-06, Vol.74, p.153-170

2017

Volltextzugriff (PDF)

Identification of novel potent human testis-specific and bromodomain-containing protein (BRDT) inhibitors using crystal structure-based virtual screening

International journal of molecular medicine, 2016-07, Vol.38 (1), p.39-44

2016

Volltextzugriff (PDF)

In Silico Docking of Medicinal Herbs Against P. gingivalis for Chronic Periodontitis Intervention

International dental journal, 2024-08

2024

Volltextzugriff (PDF)

Identification of potential inhibitors for LLM of Staphylococcus aureus: structure-based pharmacophore modeling, molecular dynamics, and binding free energy studies

Journal of biomolecular structure & dynamics, 2022-01, Vol.40 (20), p.9833-9847

2022

Volltextzugriff (PDF)

Corrigendum: Navigating bioactivity space in anti-tubercular drug discovery through the deployment of advanced machine learning models and cheminformatics tools: a molecular modeling based retrospective study

Frontiers in pharmacology, 2024-01, Vol.14, p.1340724-1340724

2024

Volltextzugriff (PDF)

POTENTIAL ACTIVITY OF KAEMPFEROL AS ANTI-PARKINSON’S; MOLECULAR DOCKING AND PHARMACOPHORE MODELLING STUDY

International journal of applied pharmaceutics, 2023-05, p.43-48

2023

Volltextzugriff (PDF)

Prediction of drug–ABC-transporter interaction — Recent advances and future challenges

Advanced drug delivery reviews, 2015-06, Vol.86, p.17-26

2015

Volltextzugriff (PDF)

Ligand-Based Pharmacophore Modeling Using Novel 3D Pharmacophore Signatures

Molecules (Basel, Switzerland), 2018-11, Vol.23 (12), p.3094

2018

Volltextzugriff (PDF)

Computer-aided screening for potential TMPRSS2 inhibitors: a combination of pharmacophore modeling, molecular docking and molecular dynamics simulation approaches

Journal of biomolecular structure & dynamics, 2021-09, Vol.39 (15), p.5638-5656

2021

Volltextzugriff (PDF)

Computational investigation of novel farnesyltransferase inhibitors using 3D-QSAR pharmacophore modeling, virtual screening, molecular docking and molecular dynamics simulation studies: A new insight into cancer treatment

Journal of molecular structure, 2021-10, Vol.1241, p.130667, Article 130667

2021

Volltextzugriff (PDF)

Cheminformatics approaches to predict the bioactivity and to discover the pharmacophoric traits crucial to block NF-κB

Chemical physics impact, 2024-12, Vol.9, p.100720, Article 100720

2024

Volltextzugriff (PDF)

Pharmacophore based virtual screening for identification of effective inhibitors to combat HPV 16 E6 driven cervical cancer

European journal of pharmacology, 2023-10, Vol.957, p.175961-175961, Article 175961

2023

Volltextzugriff (PDF)

Discovery of anti-MERS-CoV small covalent inhibitors through pharmacophore modeling, covalent docking and molecular dynamics simulation

Journal of molecular liquids, 2021-05, Vol.330, p.115699-115699, Article 115699

2021

Volltextzugriff (PDF)

Pharmacophore-based virtual screening & molecular docking studies on selected plant constituents of Plantago major

Journal of applied pharmaceutical science, 2023-04

2023

Volltextzugriff (PDF)

In silico identification and biochemical validation of plausible molecular targets of 4-thiazolidinone derivative Les-3833 as a potential anticancer agent

Ukrainian biochemical journal, 2021-05, Vol.93 (2), p.7-22

2021

Volltextzugriff (PDF)

Virtual screening and biological evaluation to identify pharmaceuticals potentially causing hypertension and hypokalemia by inhibiting steroid 11β-hydroxylase

Toxicology and applied pharmacology, 2023-09, Vol.475, p.116638-116638, Article 116638

2023

Volltextzugriff (PDF)

Discovering novel inhibitors of P2Y12 receptor using structure-based virtual screening, molecular dynamics simulation and MMPBSA approaches

Computers in biology and medicine, 2022-08, Vol.147, p.105743-105743, Article 105743

2022

Volltextzugriff (PDF)

Synthesis and characterization for pharmaceutical models from Co(II), Ni(II) and Cu(II)-thiophene complexes; apoptosis, various theoretical studies and pharmacophore modeling

Journal of molecular liquids, 2021-04, Vol.328, p.115483, Article 115483

2021

Volltextzugriff (PDF)

1 – 25 von 1.015

Suche als RSS-Feed

Aktive Filter

ThemaDrug Design

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(916)
Mit Volltextzugriff
(850)

Publikationsform

2 weitere anzeigen...

Weniger anzeigen...

Sprache

2 weitere anzeigen...

Weniger anzeigen...

Erscheinungsjahr

n.n

Thema

15 weitere anzeigen...

Weniger anzeigen...

Neu hinzugefügt

... seit 90 Tagen
(17)
... seit 30 Tagen
(5)

Menü

Weitere Dienste

Einstellungen

ePharmer: An integrated and graphical software for pharmacophore‐based virtual screening

Structure‐based pharmacophore modeling, virtual screening approaches to identifying the potent hepatitis C viral protease and polymerase novel inhibitors

Fragment-based discovery of new potential DNMT1 inhibitors integrating multiple pharmacophore modeling, 3D-QSAR, virtual screening, molecular docking, ADME, and molecular dynamics simulation approaches

Identification of natural compound inhibitors against PfDXR: A hybrid structure‐based molecular modeling approach and molecular dynamics simulation studies

Drug Design by Pharmacophore and Virtual Screening Approach

Pharmacophore development, drug-likeness analysis, molecular docking, and molecular dynamics simulations for identification of new CK2 inhibitors

Identification of new small molecules as dual FoxM1 and Hsp70 inhibitors using computational methods

First universal pharmacophore model for hERG1 K+ channel activators: acthER

Identification of novel potent human testis-specific and bromodomain-containing protein (BRDT) inhibitors using crystal structure-based virtual screening

In Silico Docking of Medicinal Herbs Against P. gingivalis for Chronic Periodontitis Intervention

Identification of potential inhibitors for LLM of Staphylococcus aureus: structure-based pharmacophore modeling, molecular dynamics, and binding free energy studies

Corrigendum: Navigating bioactivity space in anti-tubercular drug discovery through the deployment of advanced machine learning models and cheminformatics tools: a molecular modeling based retrospective study

POTENTIAL ACTIVITY OF KAEMPFEROL AS ANTI-PARKINSON’S; MOLECULAR DOCKING AND PHARMACOPHORE MODELLING STUDY

Prediction of drug–ABC-transporter interaction — Recent advances and future challenges

Ligand-Based Pharmacophore Modeling Using Novel 3D Pharmacophore Signatures

Computer-aided screening for potential TMPRSS2 inhibitors: a combination of pharmacophore modeling, molecular docking and molecular dynamics simulation approaches

Computational investigation of novel farnesyltransferase inhibitors using 3D-QSAR pharmacophore modeling, virtual screening, molecular docking and molecular dynamics simulation studies: A new insight into cancer treatment

Cheminformatics approaches to predict the bioactivity and to discover the pharmacophoric traits crucial to block NF-κB

Pharmacophore based virtual screening for identification of effective inhibitors to combat HPV 16 E6 driven cervical cancer

Discovery of anti-MERS-CoV small covalent inhibitors through pharmacophore modeling, covalent docking and molecular dynamics simulation

Pharmacophore-based virtual screening & molecular docking studies on selected plant constituents of Plantago major

In silico identification and biochemical validation of plausible molecular targets of 4-thiazolidinone derivative Les-3833 as a potential anticancer agent

Virtual screening and biological evaluation to identify pharmaceuticals potentially causing hypertension and hypokalemia by inhibiting steroid 11β-hydroxylase

Discovering novel inhibitors of P2Y12 receptor using structure-based virtual screening, molecular dynamics simulation and MMPBSA approaches

Synthesis and characterization for pharmaceutical models from Co(II), Ni(II) and Cu(II)-thiophene complexes; apoptosis, various theoretical studies and pharmacophore modeling

Aktive Filter

Suchergebnisse filtern