Search Result "ADMET score"

Research Article

In Silico Docking, ADMET and QSAR Study of few Antimalarial Phytoconstituents as Inhibitors of Plasmepsin II of P. falciparum Against Malaria

Journal: Current Drug Therapy
Volume: 15 Issue: 3 Year: 2020 Page: 264-273
Author(s): Syeda Sabiha Salam,Pankaj Chetia,Devid Kardong

Research Article

Pyridine and Benzoisothiazole Decorated Vanillin Chalcones: Synthesis, Antimicrobial, Antioxidant, Molecular Docking Study and ADMET Properties

Journal: Current Organic Synthesis
Volume: 17 Issue: 5 Year: 2020 Page: 367-381
Author(s): Pintu Pathare,Sunil Tekale,Rafique Shaikh,Manoj Damale,Jaiprakash Sangshetti,Dhanaji Rajani,Rajendra Pawar

Research Article

In Silico ADMET and Docking Studies of Thiazolidinedione-acetic-acid Hybrids as Antidiabetics with Cardioprotection

Journal: Letters in Drug Design & Discovery
Volume: 17 Issue: 1 Year: 2020 Page: 1475-1484
Author(s): Deepanwita Maji,Subir Samanta,Vaishali M. Patil

Research Article

Computational Studies of bis-2-Oxoindoline Succinohydrazides and their In Vitro Cytotoxicity

Journal: Current Computer-Aided Drug Design
Volume: 16 Issue: 3 Year: 2020 Page: 270-280
Author(s): Ravi Jarapula,Vishnu N. Badavath,Shriram Rekulapally,Sarangapani Manda

Research Article open access plus

Identification of Phosphoinositide-3 Kinases Delta and Gamma Dual Inhibitors Based on the p110δ/γ Crystal Structure

Journal: Letters in Drug Design & Discovery
Volume: 17 Issue: 6 Year: 2020 Page: 780-794
Author(s): Wen-Qing Jia,Xiao-Yan Feng,Ya-Ya Liu,Zhen-Zhen Han,Zhi Jing,Wei-Ren Xu,Xian-Chao Cheng

Research Article

Structure-based Virtual Screening Approach for the Discovery of Potent Inhibitors of Aminoglycoside 6'-N-Acetyltransferase Type Ib [AAC(6')-Ib] against K. pneumoniae Infections

Journal: Letters in Drug Design & Discovery
Volume: 17 Issue: 8 Year: 2020 Page: 1027-1035
Author(s): Reaz Uddin,Bushra Siraj,Sidra Rafi,Syed Sikander Azam,Abdul Wadood

Research Article

In Silico Anticancer Evaluation, Molecular Docking and Pharmacophore Modeling of Flavonoids against Various Cancer Targets

Journal: Letters in Drug Design & Discovery
Volume: 17 Issue: 1 Year: 2020 Page: 1485-1501
Author(s): Jainey Puthenveettil James,Pankaj Kumar,Abhishek Kumar,Katte Ishwar Bhat,Chakrakodi Shashidhara Shastry

Research Article

A Comparative Study to Explore the Effect of Different Compounds in Immune Proteins of Human Beings Against Tuberculosis: An In-Silico Approach

Journal: Current Bioinformatics
Volume: 15 Issue: 2 Year: 2020 Page: 155-164
Author(s): Manish Kumar Tripathi,Mohammad Yasir,Pushpendra Singh,Rahul Shrivastava

Computational Druglikeness Assessment, Synthesis, Characterization and In vitro Biological Activity Evaluation of some Novel Mixed Metal Complexes of 2-(butan-2-ylidene) Hydrazinecarbothioamide

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 23 Issue: 0 Year: 2020 Page: 1-22
Author(s): Tahmeena Khan,Iqbal Azad,Alfred J. Lawrence,Saman Raza,Seema Joshi,Abdul Rahman Khan

Research Article

Evaluation of Kaempferol as AKT Dependent mTOR Regulator via Targeting FKBP-12 in Hepatocellular Carcinoma: an In silico Approach

Journal: Letters in Drug Design & Discovery
Volume: 17 Issue: 1 Year: 2020 Page: 1401-1408
Author(s): Pooja Siniprasad,Bhagyalakshmi Nair,Vaisali Balasubramaniam,Prashanth Sadanandan,Puliyapally Krishnan Namboori,Lekshmi Reghu Nath

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