Submissions from 2026
A General Predictive and Conceptual Model for Repulsive Electronic States in Valence Ionized Molecules, Luka Dockx, Bálint Sztáray, and Anthony Dutoi
Submissions from 2025
Inhibition of MIF with an Allosteric Inhibitor Triggers Cell Cycle Arrest in Acute Myeloid Leukemia, Georgios Pantouris, Leepakshi Khurana, Pathricia Tilstam, Alison Benner, Thomas Yoonsang Cho, Martin Lelaidier, Mathieu Perrée, Zoe Rosenbaum, Lin Leng, Francine Foss, Vineet Bhandari, Amit Verma, Richard Bucala, and Elias J. Lolis
Submissions from 2024
Conformational Flexibility of the C-Terminal Region Influences Distal Active Site Residues Across the Tautomerase Superfamily, Christopher Argueta, Andrew Parkins, and Georgios Pantouris
Iguratimod, an allosteric inhibitor of macrophage migration inhibitory factor (MIF), prevents mortality and oxidative stress in a murine model of acetaminophen overdose, Joshua Bloom, Georgios Pantouris, Mingzhu He, Bayan Aljabari, Lopa Mishra, Ramu Manjula, Andrew Parkins, Elias J. Lolis, and Yousef Al-Abed
Submissions from 2023
Time-resolved cryo-EM (TR-EM) analysis of substrate polyubiquitination by the RING E3 anaphase-promoting complex/cyclosome (APC/C), Tatyana Bodrug, Kaeli A. Welsh, Derek L. Bolhuis, Ethan Paulаkonis, Raquel C. Martinez-Chacin, Bei Liu, Nicholas Pinkin, Thomas Bonacci, Liying Cui, Pengning Xu, Olivia Roscow, Sascha Josef Amann, Irina Grishkovskaya, Michael J. Emanuele, Joseph S. Harrison, Joshua P. Steimel, Klaus M. Hahn, Wei Zhang, Ellen D. Zhong, David Haselbach, and Nicholas G. Brown
Storage and Algal Association of Bacteria That Protect Microchloropsis salina from Grazing by Brachionus plicatilis, Carolyn L. Fisher, Michelle V. Fong, Pamela D. Lane, Skylar Carlson, and Todd W. Lane
A Streptomyces tendae Specialized Metabolite Inhibits Quorum Sensing in Group A Streptococcus, Vanessa M. Nepomuceno, Kaitlyn M. Tylor, Skylar Carlson, Michael J. Federle, Brian T. Murphy, and Tiara Perez Morales
Protocol for purification and enzymatic characterization of members of the human macrophage migration inhibitory factor superfamily, Andrew Parkins and Georgios Pantouris
Analysis of CD74 Occurrence in Oncogenic Fusion Proteins, Jasmine Vargas and Georgios Pantouris
Characterizing the consensus residue specificity and surface of BCL-2 binding to BH3 ligands using the Knob-Socket model, Jennifer Yi, Vivian Kellner, Hyun Joo, Nathaniel Chien, Shivarni Patel, Zaina Chaban, and Jerry Tsai
Submissions from 2022
Ice-nucleating agents in sea spray aerosol identified and quantified with a holistic multimodal freezing model, Peter A. Alpert, Wendy P. Kilthau, Rachel E. O'Brien, Ryan C. Moffet, Mary K. Gilles, Bingbing Wang, Alexander Laskin, Josephine Y. Aller, and Daniel A. Knopf
Coevolutionary Analysis Implicates Toll-Like Receptor 9 in Papillomavirus Restriction, Kelly King, Brendan B. Larsen, Sophie Gryseels, Cécile Richet, Simona Kraberger, Robert Jackson, Michael Worobey, Joseph S. Harrison, Arvind Varsani, and Koenraad Van Doorslaer
Solid organic-coated ammonium sulfate particles at high relative humidity in the summertime Arctic atmosphere, Rachel M. Kirpes, Ziying Lei, Matthew Fraund, Matthew J. Gunsch, Nathaniel W. May, Tate E. Barrett, Claire E. Moffett, Andrew J. Schauer, Becky Alexander, Lucia M. Upchurch, Swarup China, Patricia K. Quinn, Ryan C. Moffet, Alexander Laskin, Rebecca J. Sheesley, Kerri A. Pratt, and Andrew P. Ault
A Cysteine Variant at an Allosteric Site Alters MIF Dynamics and Biological Function in Homo- and Heterotrimeric Assemblies, Erin Skeens, Georgios Pantouris, Dilip Shah, Ramu Manjula, Michael J. Ombrello, N. Karl Maluf, Vineet Bhandari, George P. Lisi, and Elias J. Lolis
Submissions from 2021
Co-evolutionary analysis suggests a role for TLR9 in papillomavirus restriction, Kelly King, Brendan B. Larsen, Sophie Gryseeis, Cécile Richet, Simona Kraberger, Robert Jackson, Michael Worobey, Joseph S. Harrison, Arvind Varsani, and Koenraad Van Doorslaer
Designed, highly expressing, thermostable dengue virus 2 envelope protein dimers elicit quaternary epitope antibodies, Stephen T. Kudlacek, Stefan Metz, Devina Thiono, Alexander M. Payne, Thanh T.N. Phan, Shaomin Tian, Lawrence J. Forsberg, Jack McGuire, Ian Selm, Shu Zhang, Ashutosh Tripathy, Joseph S. Harrison, Nathan I. Niceley, Sandrine Soman, Michael K. McCracken, Gregory D. Gromowski, Richard G. Jarman, Lakshmanane Premkumar, Aravinda M. de Silva, and Brian Kuhlman
Linkage-specific ubiquitin chain formation depends on a lysine hydrocarbon ruler, Joanna Liwocha, David T. Krist, Gerbrand J. van der Heden van Noort, Fynn M. Hansen, Vinh H. Truong, Ozge Karayel, Nicholas Purser, Daniel Houston, Nicole Burton, Mark J. Bostock, Michael Sattler, Matthias Mann, Joseph S. Harrison, Gary Kleiger, Huib Ovaa, and Brenda A. Schulman
Mechanically transduced immunosorbent assay to measure protein-protein interactions, Christopher J. Petell, Kathyrn Randene, Michael Pappas, Diego Sandoval, Brian Dstrahl, Joseph S. Harrison, and Joshua P. Steimel
MIF but not MIF-2 recruits inflammatory macrophages in an experimental polymicrobial sepsis model, Pathricia Veronica Tilstam, Wibke Schulte, Thomas Holowka, Bong-Sung Kim, Jessica Nouws, Maor Sauler, Marta Piecychna, Georgios Pantouris, Elias Lolis, Lin Leng, Jürgen Bernhagen, Günter Fingerle-Rowson, and Richard Bucala
Functional conservation and divergence of the helix-turn-helix motif of E2 ubiquitin-conjugating enzymes, Kaeli A. Welsh, Derek L. Bolhuis, Anneroos E. Nederstigt, Joshua Boyer, Brenda R.S. Temple, Thomas Bonacci, Li Gu, Alban Ordureau, J. Wade Harper, Joshua P. Steimel, Qi Zhang, Michael J. Emanuele, Joseph S. Harrison, and Nicholas G. Brown
Identification of disease-linked hyperactivating mutations in UBE3A through large-scale functional variant analysis, Kellan P. Weston, Xiaoyi Gao, Jinghan Zhao, Kwang Soo Kim, Susan E. Maloney, Jill Gotoff, Sumit Parikh, Yen Chen Leu, Kuen Phon Wu, Marwan Shinawi, Joshua P. Steimel, Joseph S. Harrison, and Jason J. Yi
Submissions from 2020
In silico APC/C substrate discovery reveals cell cycle-dependent degradation of UHRF1 and other chromatin regulators, Jennifer L. Franks, Raquel C. Martinez-Chacin, Xianxi Wang, Rochelle L. Tiedemann, Thomas Bonacci, Rajarshi Choudhury, Derek L. Bolhuis, Taylor P. Enrico, Ryan D. Mouery, Jeffrey S. Damrauer, Feng Yan, Joseph S. Harrison, M. Ben Major, Katherine A. Hoadley, Aussie Suzuki, Scott B. Rothbart, Nicholas G. Brown, and Michael J. Emanuele
Enhancement of cell proliferation and motility of mammalian cells grown in co-culture with Pichia pastoris expressing recombinant human FGF-2, Henry Hieu M. Le, David Vang, Nadia Amer, Tou Vue, Colwin Yee, Hyam Kaou, Joseph S. Harrison, Nan Tori Xiao, Joan Lin-Cereghino, Geoff P. Lin-Cereghino, and Der Thor
Synthesis of novel dicyclohexeno-crown ethers with strategically incorporated double bonds for further functionalization, Carim van Beek, Vincent J. Catalano, and Vyacheslav V. Samoshin
KRAS Ubiquitination at Lysine 104 Retains Exchange Factor Regulation by Dynamically Modulating the Conformation of the Interface, Guowei Yin, Jerry Zhang, Vinay Nair, Vinh Truong, Angelo Chaia, Johnny Petela, Joseph S. Harrison, Alemayehu A. Gorfe, and Sharon L. Campbell
Submissions from 2018
Conformations of protonated AlaDap and DapAla characterized by IRMPD spectroscopy and molecular modeling, Patrick Batoon, Jos Oomens, Giel Berden, and Jianhua Ren
p62-dependent phase separation of patient-derived KEAP1 mutations and NRF2, E. W. Cloer, P. F. Siesser, E. M. Cousins, D Goldfarb, D. D. Mowrey, Joseph S. Harrison, S. J. Weir, N. V. Dokholyan, and M. B. Major
A bifunctional role for the UHRF1 UBL domain in the control of hemi-methylated DNA-dependent histone ubiquitylation, Joseph S. Harrison, Paul A. DaRosa, Alex Zelter, Trisha N. David, Peter Brzovic, Brian Kuhlman, and Rachel E. Klevit
Synthesis and Mass Spectrometry Analysis of Oligo-Peptoids, Jianhua Ren, Yadwinder S. Mann, Yuntao Zhang, and Michael D. Browne
Comparative biochemical analysis of UHRF proteins reveals molecular mechanisms that uncouple UHRF2 from DNA methylation maintenance, Robert M. Vaughan, Bradley M. Dickson, Evan M. Cornett, Joseph S. Harrison, Brian Kuhlman, and Scott B. Rothbart
Submissions from 2017
Simulation of X-ray transient absorption for following vibrations in coherently ionized F2 molecules, Anthony D. Dutoi and Stephen Leone
Submissions from 2016
Proton affinity of isomeric dipeptides containing lysine and nonproteinogenic lysine-homologs, Patrick Batoon and Jianhua Ren
Dual RING E3 Architectures Regulate Multiubiquitination and Ubiquitin Chain Elongation by APC/C, Nicholas G. Brown, Ryan VanderLinden, Edmond R. Watson, Florian Weissmann, Alban Ordureau, Kuen-Phon Wu, Wei Zhang, Shanshan Yu, Peter Y. Mercredi, Joseph S. Harrison, Iain F. Davidson, Renping Qiao, Ying Lu, Prakash Dube, Michael R. Brunner, Christy R. R. Grace, Darcie J. Miller, David Haselbach, Marc A. Jarvis, Masaya Yamaguchi, David Yanishevski, Georg Petzold, Sachdev S. Sidhu, Brian Kuhlman, Marc W. Kirschner, J. Wade Harper, Jan-Michael Peters, Holger Stark, and Brenda A. Schulman
Isolation and Characterization of Two Polyphenols from Strawberries, Gurbir Gudial, Ilona Serebnitskaya, and Andreas H. Franz
Oxidative esterification of primary alcohols with TEMPO/CaCl2/Oxone under hydrous conditions, Sven Hackbusch and Andreas H. Franz
Hemi-methylated DNA regulates DNA methylation inheritance through allosteric activation of H3 ubiquitylation by UHRF1, Joseph S. Harrison, Evan M. Cornett, Dennis Goldfarb, Paul A. DaRosa, Zimeng M. Li, Feng Yan, Bradley M. Dickson, Angela H. Guo, Daniel V. Cantu, Lilia Kaustov, Peter J. Brown, Cheryl H. Arrowsmith, Dorothy A. Erie, Michael B. Major, Rachel E. Klevit, Krzysztof Krajewski, Brian Kuhlman, Brian D. Strahl, and Scott B. Rothbart
UbSRD: The Ubiquitin Structural Relational Database, Joseph S. Harrison, Tim M. Jacobs, Kevin Houlihan, Koenraad Van Doorslaer, and Brian Kuhlman
Mechanism of Lysine 48 Selectivity during Polyubiquitin Chain Formation by the Ube2R1/2 Ubiquitin-Conjugating Enzyme, Spencer Hill, Joseph S. Harrison, Steven M. Lewis, Brian Kuhlman, and Gary Kleiger
Differential secretion pathways of proteins fused to the Escherichia coli maltose binding protein (MBP) in Pichia pastoris, Pachai S. Moua, Alfonso Gonzalez, Kristin T. Oshiro, Vivian Tam, Zhiguo Harry Li, Jennifer Chang, Wilson Leung, Amy Yon, Der Thor, Sri Venkatram, Andreas H. Franz, Douglas D. Risser, Joan Lin-Cereghino, and Geoff P. Lin-Cereghino
Identification and Characterization of MCM3 as a Kelch-like ECH-associated Protein 1 (KEAP1) Substrate, Kathleen M. Mulvaney, Jacob P. Matson, Priscila F. Siesser, Tigist Y. Tamir, Dennis Goldfarb, Timothy M. Jacobs, Erica W. Cloer, Joseph S. Harrison, Cyrus Vaziri, Jeanette G. Cook, and Michael B. Major
Glutamine Triggers Acetylation-Dependent Degradation of Glutamine Synthetase via the Thalidomide Receptor Cereblon, Thang Van Nguyen, J. Eugene Lee, Michael J. Sweredoski, Seung-Joo Yang, Seung-Je Jeon, Joseph S. Harrison, Jung-Hyuk Yim, Sang Ghil Lee, Hiroshi Handa, Brian Kuhlman, Ji-Seon Jeong, Justin M. Reitsma, Chul-Seung Park, Sonja Hess, and Raymond J. Deshaies
Fragmentation patterns and mechanisms of singly and doubly protonated peptoids studied by collision induced dissociation, Jianhua Ren, Yuan Tian, Ekram Hossain, and Michael Connolly
Submissions from 2015
Proton Affinity of Dipeptides Containing Alanine and Diaminobutyric Acid, Patrick Batoon and Jianhua Ren
Acylation of trans-2-substituted cyclohexanols: The impact of substituent variation on the pyridine-induced reversal of diastereoselectivity, Sven Hackbusch and Andreas H. Franz
Data in support of UbSRD: The Ubiquitin Structural Relational Database, Joseph S. Harrison, Tim M. Jacobs, Kevin Houlihan, Koenraad Van Doorslaer, and Brian Kuhlman
Efficient photochemical synthesis of peptide-α-phenylthioesters, Andrew Pardo, Tyrone J. Hogenauer, Zhefeng Cai, Julian A. Vellucci, Efrain M. Castillo, Carl W. Dirk, Andreas H. Franz, and Katja Michael
A biomimetic approach for enhancing the in vivo half-life of peptides, Sravan C. Penchala, Mark R. Miller, Arindom Pal, Jin Dong, Nikhil R. Madadi, Jinghang Xie, Hyun Joo, Jerry Tsai, Patrick Batoon, Vyacheslav V. Samoshin, Andreas H. Franz, Trevor Cox, Jesse Miles, William K. Chan, Miki S. Park, and Mamoun M. Alhamadsheh
Advances in molecular quantum chemistry contained in the Q-Chem 4 program package, Yihan Shao, Zhengting Gan, Evgeny Epifanovsky, Michael Wormit, Joerg Kussmann, Adrian Lange, Andrew Behn, Jia Deng, Xintian Feng, Debashree Ghosh, Matthew Goldey, Paul R. Horn, Leif D. Jacobson, Ilya Kaliman, Rustam Z. Khaliullin, Tomasz Kus, Arie Landau, Jie Liu, Emil I. Proynov, Young Min Rhee, Ryan M. Richard, Mary A. Rohrdanz, Ryan P. Steele, Eric J. Sundstrom, H. Lee Woodcock III, Paul M. Zimmerman, Dmitry Zuev, Ben Albrecht, Ethan Alguire, Brian Austin, Gregory J. O. Beran, Yves A. Bernard, Eric Berquist, Kai Brandhorst, Ksenia B. Bravaya, Shawn T. Brown, David Casanova, Chun-Min Chang, Yunqing Chen, Siu Hung Chien, Kristina D. Closser, Deborah L. Crittenden, Michael Diedenhofen, Robert A. DiStasio Jr., Hainam Do, and Anthony Dutoi
An Allosteric Interaction Links USP7 to Deubiquitination and Chromatin Targeting of UHRF1, Zhi-Min Zhang, Scott B. Rothbart, David F. Allison, Qian Cai, Joseph S. Harrison, Lin Li, Yinsheng Wang, Brian D. Strahl, Gang Greg Wang, and Jikui Song
trans-2-Aminocyclohexanol-based amphiphiles as highly efficient helper lipids for gene delivery by lipoplexes, Yu Zheng, Xin Liu, Nataliya M. Samoshina, Vyacheslav V. Samoshin, Andreas H. Franz, and Xin Guo
Submissions from 2014
Electron capture dissociation studies of the fragmentation patterns of doubly protonated and mixed protonatedsodiated peptoids, Bogdan Bogdanov, Xiaoning Zhao, David B. Robinson, and Jianhua Ren
Convenient synthesis of 1,3-dithiolane-2-thiones: cyclic trithiocarbonates as conformational locks, Irina A. Dotsenko, Qinliang Zhao, Andreas H. Franz, Patrick Batoon, Nataliya M. Samoshina, and Vyacheslav V. Samoshin
Visualising many-body electron dynamics using one-body densities and orbitals, Anthony D. Dutoi
Time-resolved pump-probe spectroscopy to follow valence electronic motion in molecules: Application, Anthony D. Dutoi and Lorenz Cederbaum
Structure assignment and H/D-exchange behavior of several glycosylated polyphenols, Andreas H. Franz, Ilona Serebnitskaya, Gurbir Gudial, and Christopher Wallis
Structural characterization of the glycoprotein GP2 core domain from the CAS virus, a novel arenavirus-like species, Jayne F. Koellhoffer, Zhou Dai, Vladimir N. Malashkevich, Mark D. Stenglein, Yanyun Liu, Rafael Toro, Joseph S. Harrison, Kartik Chandran, Joseph L. DeRisi, Steven C. Almo, and Jonathan R. Lai
Thio-β-D-glucosides: synthesis and evaluation as glycosidase inhibitors and activators, Andrey V. Samoshin, Irina A. Dotsenko, Nataliya M. Samoshina, Andreas H. Franz, and Vyacheslav V. Samoshin
Examples of Amine-Induced Reversal of Diastereoselectivity during Acylation of trans-1,2-Substituted Cyclohexanols, Amelia Watson, Sven Hackbusch, Vyacheslav V. Samoshin, and Andreas H. Franz
Submissions from 2013
Time-resolved pump-probe spectroscopy to follow valence electronic motion in molecules: Theory, Anthony D. Dutoi, Kirill Gokhberg, and Lorenz Cederbaum
Attenuated second-order Møller–Plesset perturbation theory: performance within the aug-cc-pVTZ basis, Matthew Goldey, Anthony D. Dutoi, and Martin Head-Gordon
Role of electrostatic repulsion in controlling pH-dependent conformational changes of viral fusion proteins, Joseph S. Harrison, Chelsea D. Higgins, Matthew J. O'Meara, Jayne F. Koellhoffer, Brian A. Kuhlman, and Jonathan R. Lai
Mechanism of ubiquitin ligation and lysine prioritization by a HECT E3, Hari B. Kamadurai, Yu Qiu, Alan Deng, Joseph S. Harrison, Chris Macdonald, Marcelo Actis, Patrick Rodrigues, Darcie J. Miller, Judith Souphron, Steven M. Lewis, Igor Kurinov, Naoaki Fujii, Michal Hammel, Robert Piper, Brian Kuhlman, and Brenda A. Schulman
Determination of the Gas-Phase Acidities of Oligopeptides, Jianhua Ren, Ashish Sawhney, Yuan Tian, Bhupinder Padda, and Patrick Batoon
Side chain requirements for affinity and specificity in D5, an HIV-1 antibody derived from the VH1-69 germline segment, Alex Stewart, Joseph S. Harrison, Lauren K. Regula, and Jonathan R. Lai
Submissions from 2012
Time-resolved Pump-Probe Spectroscopy to Follow Valence Electron Motion, Anthony D. Dutoi, Kirill Gokhberg, and Lorenz Cederbaum
Marburg virus glycoprotein GP2: pH-dependent stability of the ectodomain α-helical bundle, Joseph S. Harrison, Jayne F. Koellhoffer, Kartik Chandran, and Jonathan R. Lai
Crystal structure of the Marburg virus GP2 core domain in its postfusion conformation, Jayne F. Koellhoffer, Vladimir N. Malashkevich, Joseph S. Harrison, Rafael Toro, Rahul C. Bhosle, Kartik Chandran, Steven C. Almo, and Jonathan R. Lai
Shaping the Properties of Peptides: Helix Conformational Effects on the Acidities of Helical Peptides, Jianhua Ren
The first example of amine-induced reversal of diastereoselectivity in acylation of some trans-2-substituted cyclohexanols, Andrey V. Samoshin, Jasper Visser, Matthew Curtis, Vyacheslav V. Samoshin, and Andreas H. Franz
Gas Phase Acidity of a Cysteine Residue in Small Oligopeptides, Jialin Shen and Jianhua Ren
Analysis of the 5' untranslated region (5'UTR) of the alcohol oxidase 1 (AOX1) gene in recombinant protein expression in Pichia pastoris, Chris A. Staley, Amy Huang, Maria Nattestad, Kristin T. Oshiro, Laura E. Ray, Tejas Mulye, Zhiguo Harry Li, Thu Le, Justin J. Stephens, Seth R. Gomez, Allison D. Moy, Jackson C. Nguyen, Andreas H. Franz, Joan Lin-Cereghino, and Geoff P. Lin-Cereghino
Fliposomes: pH-controlled release from liposomes containing new trans-2-morpholinocyclohexanol-based amphiphiles that perform a conformational flip and trigger an instant cargo release upon acidification, Yu Zheng, Xin Liu, Nataliya M. Samoshina, Vyacheslav A. Chertkov, Andreas H. Franz, Xin Guo, and Vyacheslav V. Samoshin
Submissions from 2011
An Excited Electron Avoiding a Positive Charge, Anthony D. Dutoi and Lorenz Cederbaum
Ultrafast charge separation driven by differential particle and hole mobilities., Anthony D. Dutoi, Michael Wormit, and Lorenz Cederbaum
Designed protein mimics of the Ebola virus glycoprotein GP2 α-helical bundle: stability and pH effects, Joseph S. Harrison, Chelsea D. Higgins, Kartik Chandran, and Jonathan R. Lai
Synthesis of nucleobase-calix[4]arenes via click chemistry and evaluation of their complexation with alkali metal ions and molecular assembly, Wanbo Liu, Mikael A. Minier, Andreas H. Franz, Matthew Curtis, and Liang Xue
Inhibition of Ebola virus entry by a C-peptide targeted to endosomes, Emily Happy Miller, Joseph S. Harrison, Sheli R. Radoshitzky, Chelsea D. Higgins, Xiaoli Chi, Lian Dong, Jens H. Kuhn, Sina Bavari, Jonathan R. Lai, and Kartik Chandran
Tandem Mass Spectrometry Studies of Protonated and Alkali Metalated Peptoids: Enhanced Sequence Coverage by Metal Cation Addition, Kiran Kumar Morishetti, Scott C. Russell, Xiaoning Zhao, David B. Robinson, and Jianhua Ren
Generation and Characterization of Distonic Dehydrophenoxide Radical Anions under Electrospray and Atmospheric Pressure Chemical Ionizations, Kiran Kumar Morishetti, Prabhakar Sripadi, Vairamani Mariappanadar, and Jianhua Ren
Fliposomes: pH-sensitive liposomes containing a trans-2-morpholinocyclohexanol-based lipid that performs a conformational flip and triggers an instant cargo release in acidic medium, Nataliya M. Samoshina, Xin Liu, Barbora Brazdova, Andreas H. Franz, Vyacheslav V. Samoshin, and Xin Guo
Aldehyde Complexes with Protonated Peptides in Gas Phase, Xiangguo Shi, Jianhua Ren, and Joel H. Parks
Submissions from 2010
Contribution of light chain residues to high affinity binding in an HIV-1 antibody explored by combinatorial scanning mutagenesis, Gustavo F. Da Silva, Joseph S. Harrison, and Jonathan R. Lai
An Additive Long-range Potential to Correct for the Charge-transfer Failure of Time-dependent Density Functional Theory, Andreas Dreuw, Jürgen Plötner, Michael Wormit, Martin Head-Gordon, and Anthony D. Dutoi
Tracing molecular electronic excitation dynamics in real time and space., Anthony D. Dutoi, Lorenz Cederbaum, Michael Wormit, Jan Starcke, and Andreas Dreuw
Regioselective Bromination of a Thymine-Acridine Conjugate by N-Bromosuccinimide, Wanbo Liu, Engelbert Navarro, Andreas H. Franz, and Liang Xue
Secretion and proteolysis of heterologous proteins fused to the Escherichia coli maltose binding protein, Zhiguo Li, Wilson Leung, Amy Yon, John Nguyen, Vincent C. Perez, Jane Vu, William Giang, Linda T. Luong, Tracy Phan, Kate A. Salazar, Seth R. Gomez, Colin Au, Fan Xiang, David W. Thomas, Andreas H. Franz, Joan Lin-Cereghino, and Geoff P. Lin-Cereghino
An improved method for enhanced production and biological activity of human secretory leukocyte protease inhibitor (SLPI) in Pichia pastoris, Zhiguo Li, Allison Moy, Seth R. Gomez, Andreas H. Franz, Joan Lin-Cereghino, and Geoff P. Lin-Cereghino
Gas-Phase Acidities of Cysteine-Polyglycine Peptides: The Effect of the Cysteine Position, Kiran Kumar Morishetti, Betty De Suan Huang, Jessica Marney Yates, and Jianhua Ren
Gas-Phase Acid-Base Properties of Melamine and Cyanuric Acid, Sumit Mukherjee and Jianhua Ren
Origin and Implication of Ellipticity in High-order Harmonic Generation from Aligned Molecules, S. Ramakrishna, P. A. J. Sherrat, Anthony D. Dutoi, and Tamar Seidman
Submissions from 2009
Tumor-targeted drug delivery by folate conjugated amphiphiles, Shiladitya Bhattacharya; William K. Chan; Andreas H, Franz; Xiaoling Li; and Bhaskara R. Jasti
Expression and characterization of recombinant human secretory leukocyte protease inhibitor (SLPI) protein from Pichia pastoris, Zhiguo Li, Allison Moy, Kirti Sohal, Carolyn Dam, Peter Kuo, James Whittaker, Mei Whittaker, Nejat Düzgünes, Krystyna Konopka, Andreas H. Franz, Joan Lin-Cereghino, and Geoff P. Lin-Cereghino
The Exchange Energy of a Uniform Electron Gas Experiencing a New, Flexible Range Separation, John A. Parkhill, Jeng-Da Chai, Anthony D. Dutoi, and Martin Head-Gordon
Gas-Phase Acidities of the Cysteine-Polyalanine Peptides I: A3,4CSH and HSCA3,4, Jianhua Ren, John P. Tan, and Robert T. Harper
Gas-phase scrambling of disulfide bonds during matrix-assisted laser desorption/ionization mass spectrometry analysis, Liang Zhao, Ruben T. Almaraz, Fan Xiang, Jerry L. Hendrick, and Andreas H. Franz
Submissions from 2008
Synthesis of folate-conjugated amphiphiles for tumor-targeted drug delivery, Shiladitya Bhattacharya, Andreas H. Franz, Xiaoling Li, and Bhaskara R. Jasti
Synthesis and characterization of biotin derivatives as multifunctional oligosaccharide tags, Nandkishor S. Chindarkar and Andreas H. Franz
A study of the effect of attenuation curvature on molecular correlation energies by introducing an explicit cutoff radius into two-electron integrals., Anthony D. Dutoi and Martin Head-Gordon
Syntheses of small cluster oligosaccharide mimetics, Andreas H. Franz, Paul H. Gross, and Vyacheslav V. Samoshin
Stabilizing helical peptides with negative polarity or charge: capping with cysteine, Silvya Oommachen, Thomas Chun, Jianhua Ren, and C. Michael McCallum
