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Small molecules

Energetic Landscape of MDM2-p53 Interactions by Computational Mutagenesis of the MDM2-p53 Interaction

Kelly M. Thayer, George A. Beyer

GPU-Accelerated Molecular Dynamics Simulation to Study Liquid Crystal Phase Transition Using Coarse-Grained Gay-Berne Anisotropic Potential

Wenduo Chen, Youliang Zhu, [ ... ], Yunqi Li

NK Cells Respond to Haptens by the Activation of Calcium Permeable Plasma Membrane Channels

Camille Grandclément, Horst Pick, Horst Vogel, Werner Held

A New Application of Parallel Synthesis Strategy for Discovery of Amide-Linked Small Molecules as Potent Chondroprotective Agents in TNF-α-Stimulated Chondrocytes

Chia-Chung Lee, Yang Lo, [ ... ], Hsu-Shan Huang

Zinc Chloride Transiently Maintains Mouse Embryonic Stem Cell Pluripotency by Activating Stat3 Signaling

Jing Hu, Zhiyong Yang, [ ... ], Jiajing Cheng

Energetics of Transport through the Nuclear Pore Complex

Ali Ghavami, Erik van der Giessen, Patrick R. Onck

Identification of a Small Molecule Inhibitor of RAD52 by Structure-Based Selection

Katherine Sullivan, Kimberly Cramer-Morales, [ ... ], Tomasz Skorski

Conformational Sampling and Binding Site Assessment of Suppression of Tumorigenicity 2 Ectodomain

Chao-Yie Yang, James Delproposto, [ ... ], Xinquan Wang

High-Throughput Screening of Myometrial Calcium-Mobilization to Identify Modulators of Uterine Contractility

Jennifer L. Herington, Daniel R. Swale, [ ... ], Jeff Reese

Effects of Small Molecule Calcium-Activated Chloride Channel Inhibitors on Structure and Function of Accessory Cholera Enterotoxin (Ace) of Vibrio cholerae

Tanaya Chatterjee, Irshad Ali Sheikh, [ ... ], Kazi Mirajul Hoque

Composition of Overlapping Protein-Protein and Protein-Ligand Interfaces

Ruzianisra Mohamed, Jennifer Degac, Volkhard Helms

A Nano-MgO and Ionic Liquid-Catalyzed ‘Green’ Synthesis Protocol for the Development of Adamantyl-Imidazolo-Thiadiazoles as Anti-Tuberculosis Agents Targeting Sterol 14α-Demethylase (CYP51)

Sebastian Anusha, Baburajeev CP, [ ... ], Kanchugarakoppal S. Rangappa

Investigating Apoptozole as a Chemical Probe for HSP70 Inhibition

Lindsay E. Evans, Matthew D. Cheeseman, Norhakim Yahya, Keith Jones

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