Dahlgren, Markus K : rechercher sur Z-Library

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1

Accurate and Reliable Prediction of Relative Ligand Binding Potency in Prospective Drug Discovery by Way of a Modern Free-Energy Calculation Protocol and Force Field

Wang, Lingle, Wu, Yujie, Deng, Yuqing, Kim, Byungchan, Pierce, Levi, Krilov, Goran, Lupyan, Dmitry, Robinson, Shaughnessy, Dahlgren, Markus K., Greenwood, Jeremy, Romero, Donna L., Masse, Craig, Knigh

Journal:

Journal of the American Chemical Society

Année:

2015

Langue:

english

Fichier:

PDF, 37.64 MB

english, 2015

2

The effects of three absorption-modifying critical excipients on the in vivo intestinal absorption of six model compounds in rats and dogs

David, Dahlgren, Carl, Roos, Pernilla, Johansson, Christer, Tannergren, Anders, Lundqvist, Peter, Langguth, Markus, Sjöblom, Erik, Sjögren, Hans, Lennernäs

Journal:

International Journal of Pharmaceutics

Année:

2018

Langue:

english

Fichier:

PDF, 1.55 MB

english, 2018

3

Reaction-based Enumeration, Active Learning, and Free Energy Calculations to Rapidly Explore Synthetically Tractable Chemical Space and Optimize Potency of Cyclin-dependent Kinase 2 Inhibitors

Konze, Kyle, Bos, Pieter H., Dahlgren, Markus K., Leswing, Karl, Brohman, Ivan Tubert, Bortolato, Andrea, Robbason, Braxton, Abel, Robert, Bhat, Sathesh

Journal:

Journal of Chemical Information and Modeling

Année:

2019

Langue:

english

Fichier:

PDF, 6.04 MB

english, 2019

4

Risk factors for perineal and vaginal tears in primiparous women â the prospective POPRACT-cohort study

Jansson, Markus Harry, FranzÃ©n, Karin, Hiyoshi, Ayako, Tegerstedt, Gunilla, Dahlgren, Hedda, Nilsson, Kerstin

Journal:

BMC Pregnancy and Childbirth

Année:

2020

Fichier:

PDF, 898 KB

2020

5

Statistical molecular design of a focused salicylidene acylhydrazide library and multivariate QSAR of inhibition of type III secretion in the Gram-negative bacterium Yersinia

Markus K. Dahlgren, Caroline E. Zetterström, Åsa Gylfe, Anna Linusson, Mikael Elofsson

Journal:

Bioorganic & Medicinal Chemistry

Année:

2010

Langue:

english

Fichier:

PDF, 3.31 MB

english, 2010

6

Synthesis of 2-(2-Aminopyrimidine)-2,2-difluoroethanols as Potential Bioisosters of Salicylidene Acylhydrazides

Dahlgren, Markus K., Öberg, Christopher T., Wallin, Erika A., Janson, Pär G., Elofsson, Mikael

Journal:

Année:

2010

Langue:

english

Fichier:

PDF, 234 KB

english, 2010

7

Virtual Screening and Optimization Yield Low-Nanomolar Inhibitors of the Tautomerase Activity of Plasmodium falciparum Macrophage Migration Inhibitory Factor

Dahlgren, Markus K., Garcia, Alvaro Baeza, Hare, Alissa A., Tirado-Rives, Julian, Leng, Lin, Bucala, Richard, Jorgensen, William L.

Journal:

Journal of Medicinal Chemistry

Année:

2012

Langue:

english

Fichier:

PDF, 4.25 MB

english, 2012

8

Design, Synthesis, and Multivariate Quantitative Structure−Activity Relationship of SalicylanilidesPotent Inhibitors of Type III Secretion in Yersinia

Dahlgren, Markus K., Kauppi, Anna M., Olsson, Ing-Marie, Linusson, Anna, Elofsson, Mikael

Journal:

Journal of Medicinal Chemistry

Année:

2007

Langue:

english

Fichier:

PDF, 368 KB

english, 2007

9

Characterization of Biaryl Torsional Energetics and its Treatment in OPLS All-Atom Force Fields

Dahlgren, Markus K., Schyman, Patric, Tirado-Rives, Julian, Jorgensen, William L.

Journal:

Journal of Chemical Information and Modeling

Année:

2013

Langue:

english

Fichier:

PDF, 638 KB

english, 2013

10

Obituary

Sharma, Hitesh, Landau, Mark J., Sullivan, Todd J., Kumar, Vidya P., Dahlgren, Markus K., Jorgensen, William L., Anderson, Karen S.

Journal:

Année:

1956

Langue:

english

Fichier:

PDF, 660 KB

english, 1956

11

Virtual screening reveals allosteric inhibitors of the Toxoplasma gondii thymidylate synthase–dihydrofolate reductase

Sharma, Hitesh, Landau, Mark J., Sullivan, Todd J., Kumar, Vidya P., Dahlgren, Markus K., Jorgensen, William L., Anderson, Karen S.

Journal:

Bioorganic & Medicinal Chemistry Letters

Année:

2014

Langue:

english

Fichier:

PDF, 1.03 MB

english, 2014

12

Illuminating HIV gp120-ligand recognition through computationally-driven optimization of antibody-recruiting molecules

Parker, Christopher G., Dahlgren, Markus K., Tao, Ran N., Li, Don T., Douglass, Eugene F., Shoda, Takuji, Jawanda, Navneet, Spasov, Krasimir A., Lee, Sangil, Zhou, Nannan, Domaoal, Robert A., Sutton,

Journal:

Chemical Science

Année:

2014

Langue:

english

Fichier:

PDF, 1.04 MB

english, 2014

13

Pre-clinical pharmacokinetics and anti-chlamydial activity of salicylidene acylhydrazide inhibitors of bacterial type III secretion

Ur-Rehman, Tofeeq, Slepenkin, Anatoly, Chu, Hencelyn, Blomgren, Anders, Dahlgren, Markus K, Zetterström, Caroline E, Peterson, Ellena M, Elofsson, Mikael, Gylfe, Åsa

Journal:

The Journal of Antibiotics

Année:

2012

Langue:

english

Fichier:

PDF, 752 KB

english, 2012

14

OPLS3: a force field providing broad coverage of drug-like small molecules and proteins

Harder, Edward, Damm, Wolfgang, Maple, Jon, Wu, Chuanjie, Reboul, Mark, Xiang, Jin Yu, Wang, Lingle, Lupyan, Dmitry, Dahlgren, Markus K., Knight, Jennifer L., Kaus, Joseph W., Cerutti, David, Krilov,

Journal:

Journal of Chemical Theory and Computation

Année:

2015

Langue:

english

Fichier:

PDF, 2.40 MB

english, 2015

15

Synthesis of [4-(2-Hydroxyphenyl)thiazol-2-yl]methanones as Potential Bioisosteres of Salicylidene Acylhydrazides

Hillgren, J. Mikael, Dahlgren, Markus K., To, Tam M., Elofsson, Mikael

Journal:

Année:

2010

Langue:

english

Fichier:

PDF, 206 KB

english, 2010

16

Preclinical effect of absorption modifying excipients on rat intestinal transport of five model compounds and the intestinal barrier marker 51 Cr-EDTA

Dahlgren, David, Roos, Carl, Lundqvist, Anders, Langguth, Peter, Tannergren, Christer, Sjöblom, Markus, Sjögren, E., Lennernas, H.

Journal:

Molecular Pharmaceutics

Année:

2017

Langue:

english

Fichier:

PDF, 1.00 MB

english, 2017

17

Vascular Complications After Intestinal Transplantation- a single center experience

Fägerlind, Mattias, Gäbel, Markus, Zachrisson-Jönsson, Karin, Skogsberg-Dahlgren, Ulrika, Reivell, Veronica, Varkey, Jonas, Herlenius, Gustaf

Journal:

Transplantation Journal

Année:

2017

Langue:

english

Fichier:

PDF, 97 KB

english, 2017

18

OPLS3e: Extending Force Field Coverage for Drug-Like Small Molecules

Roos, Katarina, Wu, Chuanjie, Damm, Wolfgang, Reboul, Mark, Stevenson, James M., Lu, Chao, Dahlgren, Markus K., Mondal, Sayan, Chen, Wei, Wang, Lingle, Abel, Robert, Friesner, Richard A, Harder, Edwar

Journal:

Journal of Chemical Theory and Computation

Année:

2019

Langue:

english

Fichier:

PDF, 1.16 MB

english, 2019

19

P3.26

Dahlgren, Ulrika Skogsberg, Gäbel, Markus, Reivell, Veronica, Herlenius, Gustaf

Journal:

Transplantation Journal

Année:

2019

Langue:

english

Fichier:

PDF, 348 KB

english, 2019

20

P3.26

Dahlgren, Ulrika Skogsberg, Gäbel, Markus, Reivell, Veronica, Herlenius, Gustaf

Journal:

Transplantation Journal

Année:

2019

Fichier:

PDF, 348 KB

2019

21

Regional Intestinal Drug Permeability and Effects of Permeation Enhancers in Rat

Dahlgren, David, Cano-CebriÃ¡n, Maria-Jose, Olander, Tobias, Hedeland, Mikael, SjÃ¶blom, Markus, LennernÃ¤s, Hans

Journal:

Année:

2020

Langue:

english

Fichier:

PDF, 1.08 MB

english, 2020

22

Natural killer cell dysfunction and apoptosis induced by chronic myelogenous leukemia cells: role of reactive oxygen species and regulation by histamine

Mellqvist, Ulf-Henrik, Hansson, Markus, Brune, Mats, Dahlgren, Claes, Hermodsson, Svante, Hellstrand, Kristoffer

Journal:

Année:

2000

Fichier:

PDF, 170 KB

2000

23

Long-term response of tropical Andisol properties to conversion from rainforest to agriculture

Anda, Markus, Dahlgren, R.A.

Journal:

Année:

2020

Fichier:

PDF, 1.52 MB

2020

24

Prevention of Rat Intestinal Injury with a Drug Combination of Melatonin and Misoprostol

Dahlgren, David, Cano-CebriÃ¡n, Maria-JosÃ©, HellstrÃ¶m, Per M., Wanders, Alkwin, SjÃ¶blom, Markus, LennernÃ¤s, Hans

Journal:

International Journal of Molecular Sciences

Année:

2020

Fichier:

PDF, 1.50 MB

2020

25

Mineralogical and surface charge characteristics of Andosols experiencing long-term, land-use change in West Java, Indonesia

Anda, Markus, Dahlgren, Randy A.

Journal:

Soil Science & Plant Nutrition

Année:

2020

Fichier:

PDF, 1.41 MB

2020