In Silico Modeling and Structural Analysis of Soluble Epoxide Hydrolase Inhibitors for Enhanced Therapeutic Design.

Sar, Shuvam; Mitra, Soumya; Panda, Parthasarathi; Mandal, Subhash C; Ghosh, Nilanjan; Halder, Amit Kumar; Cordeiro, Maria Natalia D S

Sar, Shuvam; Mitra, Soumya; Panda, Parthasarathi; Mandal, Subhash C; Ghosh, Nilanjan; Halder, Amit Kumar; Cordeiro, Maria Natalia D S.

Afiliação

Sar S; Department of Pharmaceutical Technology, Jadavpur University, Kolkata 700032, India.
Mitra S; Department of Pharmaceutical Technology, Jadavpur University, Kolkata 700032, India.
Panda P; Dr. B. C. Roy College of Pharmacy and Allied Health Sciences, Campus Dr. Meghnad Saha Sarani, Durgapur 713206, India.
Mandal SC; Dr. B. C. Roy College of Pharmacy and Allied Health Sciences, Campus Dr. Meghnad Saha Sarani, Durgapur 713206, India.
Ghosh N; Department of Pharmaceutical Technology, Jadavpur University, Kolkata 700032, India.
Halder AK; Department of Pharmaceutical Technology, Jadavpur University, Kolkata 700032, India.
Cordeiro MNDS; Dr. B. C. Roy College of Pharmacy and Allied Health Sciences, Campus Dr. Meghnad Saha Sarani, Durgapur 713206, India.

Molecules ; 28(17)2023 Aug 31.

Article em En | MEDLINE | ID: mdl-37687207

Assuntos

Epóxido Hidrolases; Simulação de Dinâmica Molecular; Humanos; Reprodutibilidade dos Testes; Fontes de Energia Elétrica; Hidrolases

Palavras-chave

QSAR; Transformer-CNN; feature selection; molecular dynamics; pharmacophore; soluble epoxide hydrolase

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Texto completo: 1 Base de dados: MEDLINE Assunto principal: Epóxido Hidrolases / Simulação de Dinâmica Molecular Tipo de estudo: Guideline / Prognostic_studies Limite: Humans Idioma: En Revista: Molecules Assunto da revista: BIOLOGIA Ano de publicação: 2023 Tipo de documento: Article País de afiliação: Índia

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