Category:
Physical Chemistry
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Working Paper
, Title:
Concvar: A computer program for simulating concentration variation of complex chemical reactions
, Authors:
Tian Lu
Posted
Feb 01, 2022
Category:
Theoretical and Computational Chemistry
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Working Paper
, Title:
MATRIX EXPONENTIAL SOLUTIONS OF FIRST-ORDER CHEMICAL NETWORKS
, Authors:
harry gray
Posted
Feb 03, 2022
Category:
Chemical Education
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Working Paper
, Title:
Visualizing the Avogadro Number
, Authors:
Jesus Vicente de Julián-Ortiz, Lionello Pogliani, Emili Besalú
Posted
Feb 03, 2022
Category:
Chemical Education
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Working Paper
, Title:
Free and Open Source Software for Computational Chemistry Education
, Authors:
Susi Lehtola, Antti Karttunen
Posted
Feb 04, 2022
Category:
Catalysis
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Working Paper
, Title:
Reduction of Secondary Amides to Imines Catalysed by Schwartz’s Reagent
, Authors:
Liam Donnelly, Jean-Claude Berthet, Thibault Cantat
Posted
Feb 07, 2022
Category:
Nanoscience
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Working Paper
, Title:
Bandgaps of Atomically Precise Graphene Nanoribbons and Occam’s Razor
, Authors:
Aristides Zdetsis
Posted
Feb 08, 2022
Category:
Physical Chemistry
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Working Paper
, Title:
Using Lifetime and Quenching Rate Constant to Determine Quencher Concentration
, Authors:
Xena Soto, John Swierk
Posted
Feb 09, 2022
Category:
Theoretical and Computational Chemistry
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Working Paper
, Title:
Computational Study of Paxlovid in Ligand GA
, Authors:
Gordon Chalmers
Posted
Feb 10, 2022
Category:
Organic Chemistry
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Working Paper
, Title:
Property-driven development of privileged macrocyclic scaffolds using heterocycles
, Authors:
George Saunders, Andrei Yudin
Posted
Feb 11, 2022
Category:
Materials Chemistry
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Working Paper
, Title:
Stable Membraneless Complex Coacervate Microdroplets
, Authors:
Shang Gao, Samanvaya Srivastava
Posted
Feb 11, 2022
Category:
Catalysis
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Working Paper
, Title:
1,3,2-Diazaphospholene-Catalyzed Reductive Cyclizations of Organohalides
, Authors:
Nicolai Cramer, Johannes Klett, Lukasz Wozniak
Posted
Feb 14, 2022
Category:
Theoretical and Computational Chemistry
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Working Paper
, Title:
Multi-task Proteochemometric Modelling
, Authors:
Anastasia Pentina, Djork-Arné Clevert
Posted
Feb 16, 2022
Category:
Theoretical and Computational Chemistry
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Working Paper
, Title:
Graph-Based Molecular Pareto Optimisation
, Authors:
Jonas Verhellen
Posted
Feb 17, 2022
Category:
Nanoscience
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Working Paper
, Title:
What is the Smallest Zeolite that Could be Synthesized?
, Authors:
Debdas Dhabal, Andressa Bertolazzo, Valeria Molinero
Posted
Feb 22, 2022
Category:
Organic Chemistry
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Working Paper
, Title:
Based-Catalyzed Stereoselective Thiosulfonylation of Ynones
, Authors:
Lin He, Jinyun Luo, Muze Lin, Guangfen Du, Zhihua Cai
Posted
Feb 22, 2022
Category:
Organic Chemistry
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Working Paper
, Title:
Supramolecular rotaxane-based imaging agents targeting cancer biomarkers
, Authors:
Faustine d'Orchymont, Jason P. Holland
Posted
Feb 22, 2022
Category:
Organometallic Chemistry
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Working Paper
, Title:
The Nature of Metal-Metal Bonding in Re- and Os-Corrole Dimer
, Authors:
Aqeel A. Hussein, Mohammed Obies
Posted
Feb 23, 2022