C. V. Simoben

发表

A Novel Class of Schistosoma mansoni Histone Deacetylase 8 (HDAC8) Inhibitors Identified by Structure-Based Virtual Screening and In Vitro Testing

W. Sippl, S. Kannan, C. Romier, 2018, Molecules.

Compounds from African Medicinal Plants with Activities Against Selected Parasitic Diseases: Schistosomiasis, Trypanosomiasis and Leishmaniasis

W. Sippl, C. V. Simoben, S. H. Akoné, 2018, Natural Products and Bioprospecting.

Computational Studies and Biosynthesis of Natural Products with Promising Anticancer Properties

Aurélien F. A. Moumbock, W. Sippl, S. Günther, 2017 .

Exploring Cancer Therapeutics with Natural Products from African Medicinal Plants, Part I: Xanthones, Quinones, Steroids, Coumarins, Phenolics and other Classes of Compounds.

C. V. Simoben, F. Ntie‐Kang, L. Lifongo, 2015, Anti-cancer agents in medicinal chemistry.

Exploring Cancer Therapeutics with Natural Products from African Medicinal Plants, Part II: Alkaloids, Terpenoids and Flavonoids.

C. V. Simoben, F. Ntie‐Kang, A. Ibezim, 2015, Anti-cancer agents in medicinal chemistry.

Pharmacophore modeling and in silico toxicity assessment of potential anticancer agents from African medicinal plants

Wolfgang Sippl, Fidele Ntie-Kang, Philip Neville Judson, 2016, Drug design, development and therapy.

Novel Histone Deacetylase Inhibitors and HIV-1 Latency-Reversing Agents Identified by Large-Scale Virtual Screening

I. Tietjen, W. Sippl, C. V. Simoben, 2020, Frontiers in Pharmacology.

Pharmacoinformatic Investigation of Medicinal Plants from East Africa

Kiran K. Telukunta, Aurélien F. A. Moumbock, W. Sippl, 2020, Molecular informatics.

The uniqueness and therapeutic value of natural products from West African medicinal plants. Part I: uniqueness and chemotaxonomy

Smith B. Babiaka, W. Sippl, C. V. Simoben, 2014 .

Compounds from African Medicinal Plants with Activities against Protozoal Diseases: Schistosomiasis, Trypanosomiasis and Leishmaniasis

W. Sippl, C. V. Simoben, S. H. Akoné, 2018 .

Artificial intelligence for antiviral drug discovery in low resourced settings: A perspective

L. Montaner, I. Tietjen, Miquel Duran-Frigola, 2022, Frontiers in Drug Discovery.

A Bioactivity Versus Ethnobotanical Survey of Medicinal Plants from Nigeria, West Africa

Philip N. Judson, Conrad V. Simoben, Lydia L. Lifongo, 2014, Natural Products and Bioprospecting.

Compounds from African Medicinal Plants with Activities Against Selected Parasitic Diseases: Schistosomiasis, Trypanosomiasis and Leishmaniasis

W. Sippl, C. V. Simoben, S. H. Akoné, 2018, Natural Products and Bioprospecting.

The uniqueness and therapeutic value of natural products from West African medicinal plants, part III: least abundant compound classes

Smith B. Babiaka, W. Sippl, C. V. Simoben, 2014 .

The uniqueness and therapeutic value of natural products from West African medicinal plants, part II: terpenoids, geographical distribution and drug discovery

Wolfgang Sippl, Conrad V. Simoben, Lydia L. Lifongo, 2014 .

NANPDB: A Resource for Natural Products from Northern African Sources.

Wolfgang Sippl, Stefan Günther, Fidele Ntie-Kang, 2017, Journal of natural products.

Alkaloids with Anti-Onchocercal Activity from Voacanga africana Stapf (Apocynaceae): Identification and Molecular Modeling

Smith B. Babiaka, W. Sippl, F. Cho-Ngwa, 2020, Molecules.

In silico toxicity profiling of natural product compound libraries from African flora with anti-malarial and anti-HIV properties

Fidele Ntie-Kang, Pascal Amoa Onguéné, Conrad Veranso Simoben, 2017, Comput. Biol. Chem..

StreptomeDB 3.0: an updated compendium of streptomycetes natural products

Stefan Günther, Fidele Ntie-Kang, Mingjie Gao, 2020, Nucleic Acids Res..

Molecular Modeling of Potential Anticancer Agents from African Medicinal Plants

Wolfgang Sippl, Fidele Ntie-Kang, Akachukwu Ibezim, 2014, J. Chem. Inf. Model..

Case studies on computer-based identification of natural products as lead molecules

Fidele Ntie-Kang, Wolfgang Sippl, Conrad V. Simoben, 2020 .

Binding Free Energy (BFE) Calculations and Quantitative Structure–Activity Relationship (QSAR) Analysis of Schistosoma mansoni Histone Deacetylase 8 (smHDAC8) Inhibitors

W. Sippl, C. Romier, Ehab Ghazy, 2021, Molecules.

Design of selective histone deacetylase inhibitors: rethinking classical pharmacophore.

W. Sippl, D. Robaa, Jelena Melesina, 2018, Future medicinal chemistry.

11th German Conference on Chemoinformatics (GCC 2015)

Timothy Clark, Jonathan W. Essex, Peter Kolb, 2016, J. Cheminformatics.

NANPDB: A Resource for Natural Products from Northern African Sources.

Kiran K. Telukunta, Yvette I. Malange, W. Sippl, 2017, Journal of natural products.

Challenges in natural product-based drug discovery assisted with in silico-based methods

Aurélien F. A. Moumbock, Smith B. Babiaka, W. Sippl, 2023, RSC Advances.

Strategies To Design Selective Histone Deacetylase Inhibitors

W. Sippl, D. Robaa, Jelena Melesina, 2021, ChemMedChem.

Investigation of Some Plant Stilbenoids and their Fragments for the Identification of Inhibitors of SARS-CoV-2 Viral Spike/ACE2 Protein Binding

C. V. Simoben, F. Ntie‐Kang, B. D. Bekono, 2024, The Microbe.

Computational discovery of dual potential inhibitors of SARS-CoV-2 spike/ACE2 and Mpro: 3D-pharmacophore, docking-based virtual screening, quantum mechanics and molecular dynamics.

Pascal Amoa Onguéné, C. V. Simoben, F. Ntie‐Kang, 2024, European biophysics journal : EBJ.

5-chloro-3-(2-(2,4-dinitrophenyl) hydrazono)indolin-2-one: synthesis, characterization, biochemical and computational screening against SARS-CoV-2

J. Salvino, C. V. Simoben, F. Ntie‐Kang, 2024, Chemicke zvesti.

Emerging structure-based computational methods to screen the exploding accessible chemical space.

M. Schapira, C. V. Simoben, Corentin Bedart, 2024, Current opinion in structural biology.