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Future Medicinal Chemistry|June 10, 2020
Pathway and mechanism of drug binding to chemokine receptors revealed by accelerated molecular simulationsShristi Pawnikar, Yinglong Miao
Frontiers in Molecular Biosciences|April 1, 2022
Mechanism of Peptide Agonist Binding in CXCR4 Chemokine ReceptorShristi Pawnikar, Yinglong Miao
The Journal of Physical Chemistry Letters|May 17, 2021
Mechanism of Ligand Recognition by Human ACE2 ReceptorApurba Bhattarai, Shristi Pawnikar, Yinglong Miao
Biorxiv : the Preprint Server for Biology|November 3, 2020
Mechanism of ligand recognition by human ACE2 receptorApurba Bhattarai, Shristi Pawnikar, Yinglong Miao
Vitamins and Hormones|September 17, 2023
Structural dynamics of chemokine receptorsShristi Pawnikar, Sana Akhter, Yinglong Miao
Advances and Applications in Bioinformatics and Chemistry : AABC|January 13, 2022
Binding Analysis Using Accelerated Molecular Dynamics Simulations and Future PerspectivesShristi Pawnikar, Apurba Bhattarai, Jinan Wang, et al.
STAR Protocols|March 4, 2021
Efficient purification and assembly of ribonucleoprotein complex for interaction analysis by MST assay coupled with GaMD simulationsYunrong Gao, Dongdong Cao, Shristi Pawnikar, et al.
Proceedings of the National Academy of Sciences of the United States of America|May 6, 2022
Mechanism of tethered agonist-mediated signaling by polycystin-1Shristi Pawnikar, Brenda S Magenheimer, Ericka Nevarez Munoz, et al.
The Journal of Physical Chemistry Letters|March 10, 2023
Critical Non-Covalent Binding Intermediate for an Allosteric Covalent Inhibitor of SUMO E1Shristi Pawnikar, Apurba Bhattarai, S Xiaohu Ouyang, et al.
Plos Computational Biology|March 7, 2024
Mechanistic insights into ligand dissociation from the SARS-CoV-2 spike glycoproteinTimothy Hasse, Esra Mantei, Rezvan Shahoei, et al.
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