Quantitative structural assessments of potential meprin β inhibitors by non-linear QSAR approaches and validation by binding mode of interaction analysis-Reference-Cited by-同舟云学术

Quantitative structural assessments of potential meprin β inhibitors by non-linear QSAR approaches and validation by binding mode of interaction analysis

Published:2023 Issue:15 Volume:47 Page:7051-7069
ISSN:1144-0546
Container-title:New Journal of Chemistry
language:en
Short-container-title:New J. Chem.

Author:

Banerjee Suvankar¹^ORCID,Baidya Sandip Kumar¹^ORCID,Ghosh Balaram²^ORCID,Nandi Suvendu³^ORCID,Mandal Mahitosh³,Jha Tarun¹^ORCID,Adhikari Nilanjan¹^ORCID

Affiliation:

1. Natural Science Laboratory, Division of Medicinal and Pharmaceutical Chemistry, Department of Pharmaceutical Technology, Jadavpur University, Kolkata 700032, India

2. Epigenetic Research Laboratory, Department of Pharmacy, Birla Institute of Technology and Science-Pilani, Hyderabad Campus, Shamirpet, Hyderabad, 500078, India

3. Cancer Biology Laboratory, School of Medical Science & Technology, Indian Institute of Technology Kharagpur, Kharagpur, West Bengal 721302, India

Abstract

Identification of key structural features of meprin β inhibitors by ML models and binding mode of interaction analysis.

Publisher

Royal Society of Chemistry (RSC)

Subject

Materials Chemistry,General Chemistry,Catalysis

Link

http://pubs.rsc.org/en/content/articlepdf/2023/NJ/D2NJ04753E

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