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Molecular structure

Demonstration of physicochemical and functional similarity between Stimufend (pegfilgrastim-fpgk) and Neulasta (pegfilgrastim): A comparative analytical assessment

Alison Sykes, Louise Ingram, Ulrich Kronthaler, Laurent Chevalet

published 24 Oct 2024

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Impact of mutations in starch synthesis genes on morphological, compositional, molecular structure, and functional properties of potato starch

Shishanthi Jayarathna, Zsuzsanna Péter-Szabó, Gustav Nestor, Mariette Andersson, Francisco Vilaplana, Roger Andersson

published 26 Sep 2024

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Exploring carbon catenoids and their applications for encapsulation of carbon nanostructures

Panyada Sripaturad, Ngamta Thamwattana, Kyle Stevens, Duangkamon Baowan

published 26 Sep 2024

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Polyamines (PAs) but not small peptides with closely spaced positively charged groups interact with DNA and RNA, but they do not represent a relevant buffer system at physiological pH values

Julian Rieck, Christian Derst, Rüdiger W. Veh

published 25 Jul 2024

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Quadruplex-duplex junction in LTR-III: A molecular insight into the complexes with BMH-21, namitecan and doxorubicin

Stefania Mazzini, Gigliola Borgonovo, Salvatore Princiotto, Roberto Artali, Loana Musso, Anna Aviñó, Ramon Eritja, Raimundo Gargallo, Sabrina Dallavalle

published 24 Jul 2024

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Analysis of AlphaFold and molecular dynamics structure predictions of mutations in serpins

Pedro Garrido-Rodríguez, Miguel Carmena-Bargueño, María Eugenia de la Morena-Barrio, Carlos Bravo-Pérez, Belén de la Morena-Barrio, Rosa Cifuentes-Riquelme, María Luisa Lozano, Horacio Pérez-Sánchez, Javier Corral

published 05 Jul 2024

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LSTM-driven drug design using SELFIES for target-focused de novo generation of HIV-1 protease inhibitor candidates for AIDS treatment

M. Taleb Albrijawi, Reda Alhajj

published 21 Jun 2024

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The study of pentagonal chain with respect to schultz index, modified schultz index, schultz polynomial and modified schultz polynomial

Guofeng Yu, Shahid Zaman, Mah Jabeen, Xuewu Zuo

published 18 Jun 2024

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Deep graph contrastive learning model for drug-drug interaction prediction

Zhenyu Jiang, Zhi Gong, Xiaopeng Dai, Hongyan Zhang, Pingjian Ding, Cong Shen

published 17 Jun 2024

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Investigating molecular descriptors in cell-penetrating peptides prediction with deep learning: Employing N, O, and hydrophobicity according to the Eisenberg scale

Juliana Auzier Seixas Feio, Ewerton Cristhian Lima de Oliveira, Claudomiro de Souza de Sales Junior, Kauê Santana da Costa, Anderson Henrique Lima e Lima

published 13 Jun 2024

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Modeling transthyretin (TTR) amyloid diseases, from monomer to amyloid fibrils

Richard S. Criddle, Lee D. Hansen, Brian F. Woodfield, H. Dennis Tolley

published 06 Jun 2024

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The active time model of concurrent choice

J. Mark Cleaveland

published 21 May 2024

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Cassini-oval description of atomic binding: New insights into the quantitative relationship between hardness coefficient and bond energy energy

Weicheng Zeng

published 16 May 2024

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