Year |
Citation |
Score |
2014 |
Sambasivarao SV, Roberts J, Bharadwaj VS, Slingsby JG, Rohleder C, Mallory C, Groome JR, McDougal OM, Maupin CM. Acetylcholine promotes binding of α-conotoxin MII at α3 β2 nicotinic acetylcholine receptors. Chembiochem : a European Journal of Chemical Biology. 15: 413-24. PMID 24420650 DOI: 10.1002/Cbic.201300577 |
0.31 |
|
2014 |
McDougal OM, Cornia N, Sambasivarao SV, Remm A, Mallory C, Oxford JT, Maupin CM, Andersen T. Homology modeling and molecular docking for the science curriculum. Biochemistry and Molecular Biology Education : a Bimonthly Publication of the International Union of Biochemistry and Molecular Biology. 42: 179-82. PMID 24376157 DOI: 10.1002/Bmb.20767 |
0.3 |
|
2014 |
Granum DM, Vyas S, Sambasivarao SV, Maupin CM. Computational evaluations of charge coupling and hydrogen bonding in the active site of a family 7 cellobiohydrolase. The Journal of Physical Chemistry. B. 118: 434-48. PMID 24359013 DOI: 10.1021/Jp408536S |
0.318 |
|
2013 |
Allen C, Sambasivarao SV, Acevedo O. An ionic liquid dependent mechanism for base catalyzed β-elimination reactions from QM/MM simulations. Journal of the American Chemical Society. 135: 1065-72. PMID 23273322 DOI: 10.1021/Ja3098614 |
0.524 |
|
2012 |
Acevedo O, Ambrose Z, Flaherty PT, Aamer H, Jain P, Sambasivarao SV. Identification of HIV inhibitors guided by free energy perturbation calculations. Current Pharmaceutical Design. 18: 1199-216. PMID 22316150 DOI: 10.2174/138920012799362828 |
0.517 |
|
2011 |
Vilseck JZ, Sambasivarao SV, Acevedo O. Optimal scaling factors for CM1 and CM3 atomic charges in RM1-based aqueous simulations. Journal of Computational Chemistry. 32: 2836-42. PMID 21732390 DOI: 10.1002/Jcc.21863 |
0.527 |
|
2011 |
Sambasivarao SV, Acevedo O. Computational insight into small molecule inhibition of cyclophilins. Journal of Chemical Information and Modeling. 51: 475-82. PMID 21194235 DOI: 10.1021/Ci1004114 |
0.539 |
|
2009 |
Sambasivarao SV, Acevedo O. Development of OPLS-AA Force Field Parameters for 68 Unique Ionic Liquids. Journal of Chemical Theory and Computation. 5: 1038-50. PMID 26609613 DOI: 10.1021/Ct900009A |
0.544 |
|
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