Search Result "vdW Surface area"


In silico Based Structural Analysis of Some Piperidine Analogs as Farnesyltransferase Inhibitors

Journal: Medicinal Chemistry
Volume: 8 Issue: 5 Year: 2012 Page: 853-864
Author(s): Narayana Subbiah Hari Narayana Moorthy,Sergio F. Sousa,Maria J. Ramos,Pedro A. Fernandes

Ab Initio Studies of Anatase TiO2 (101) Surface-supported Au8 Clusters

Journal: Current Topics in Medicinal Chemistry
Volume: 15 Issue: 18 Year: 2015 Page: 1859-1867
Author(s): A. Mikolajczyk,H. P. Pinto,A. Gajewicz,T. Puzyn,J. Leszczynski

Studies on α-Glucosidase Inhibitors Development: Magic Molecules for the Treatment of Carbohydrate Mediated Diseases

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 12 Issue: 8 Year: 2012 Page: 713-720
Author(s): N. S.H.N. Moorthy,M. J. Ramos,P. A. Fernandes

QSAR and Pharmacophore Analysis of a Series of Piperidinyl Urea Derivatives as hERG Blockers and H3 Antagonists

Journal: Current Drug Discovery Technologies
Volume: 10 Issue: 1 Year: 2013 Page: 47-58
Author(s): N. S. Hari Narayana Moorthy, Maria J. Ramos, Pedro A. Fernandes

Exploring Interaction of TNF and Orthopoxviral CrmB Protein by Surface Plasmon Resonance and Free Energy Calculation

Journal: Protein & Peptide Letters
Volume: 21 Issue: 12 Year: 2014 Page: 1273-1281
Author(s): Nikita V. Ivanisenko,Tatiana V. Tregubchak,Olga V. Saik,Vladimir A. Ivanisenko,Sergei N. Shchelkunov

Human Ether-a-Go-Go-Related Gene Channel Blockers and its Structural Analysis for Drug Design

Journal: Current Drug Targets
Volume: 14 Issue: 1 Year: 2013 Page: 102-113
Author(s): N. S. Hari Narayana Moorthy,Maria J. Ramos,Pedro A. Fernandes

Estimation of the Binding Free Energy by Linear Interaction Energy Models

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 12 Issue: 6 Year: 2012 Page: 551-561
Author(s): O. Nicolotti,M. Convertino,F. Leonetti,M. Catto,S. Cellamare,A. Carotti

Analysis of the α-Glucosidase Inhibitory Activity of Chromenone Derivatives Based on their Molecular Features: A Computational Study

Journal: Medicinal Chemistry
Volume: 7 Issue: 6 Year: 2011 Page: 526-533
Author(s): N. S. Hari Narayana Moorthy, Maria J. Ramos, Pedro A. Fernandes

Modeling of HIV-1 TAR RNA-Ligand Complexes

Journal: Medicinal Chemistry
Volume: 7 Issue: 4 Year: 2011 Page: 301-308
Author(s): Petar M. Mitrasinovic, Jyoti S. Tomar, Maya S. Nair, Ritu Barthwal

Differential Interactions of Cytochrome P450 3A5 and 3A4 with Chemotherapeutic Agent-Vincristine: A Comparative Molecular Dynamics Study

Journal: Anti-Cancer Agents in Medicinal Chemistry
Volume: 15 Issue: 4 Year: 2015 Page: 475-483
Author(s): Nikhat Saba,Rajabrata Bhuyan,Suman Kumar Nandy,Alpana Seal

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