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CHARMM: The biomolecular simulation program

B. Brooks, C. Brooks, A. Mackerell, L. Nilsson, R. Petrella, B. Roux, Y. Won, G. Archontis, C. Bartels, S. Boresch, A. Caflisch, L. Caves, Q. Cui, A. Dinner, M. Feig, S. Fischer, J. Gao, M. Hodoscek, W. Im, K. Kuczera, T. Lazaridis, J. Ma, V. Ovchinnikov, E. Paci, R. Pastor, C. Post, J. Pu, M. Schaefer, B. Tidor, R. Venable, H. Woodcock, X. Wu, W. Yang, D. York, and M. Karplus. Journal of Computational Chemistry, 30 (10): 1545--1614 (2009)
DOI: 10.1002/jcc.21287

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Dumitru H l l u

Dan Woodcock

Amanda L H Tufman

Steven H L Verhelst

Jens H L Neumann

Other publications of authors with the same name

Naphthalenyl, anthracenyl, tetracenyl, and pentacenyl radicals and their anionsB. Papas, S. Wang, N. Deyonker, H. Woodcock, and H. Schaefer. J. Phys. Chem. A, 107 (32): 6311--6316 (2003)Analysis of the origin of through-space proton nmr deshielding by selected organic functional groupsN. Martin, J. Brown, K. Nance, H. Schaefer, P. Schleyer, Z. Wang, and H. Woodcock. Org. Lett., 3 (24): 3823--3826 (2001)Examining complex processes and reactions: the replica/path method.B. Brooks, H. Woodcock, T. Cheatham, and X. Wu. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, (2002)The almost bottleable triplet carbene: 2,6-dibromo-4-tert- butyl-2 ',6 '-bis(trifluoromethyl)-4 '-isopropyldiphenylcarbeneH. Woodcock, D. Moran, N. F., and Schaefer. J. Am. Chem. Soc., 123 (18): 4331--4335 (2001)Qvibs: program to perform vibrational animation of q-chem frequency analysisH. Woodcock. (2002)The microwave and infrared spectroscopy of benzaldehyde: conflict between theory and experimental deductionsL. Speakman, B. Papas, H. Woodcock, and H. Schaefer. J. Chem. Phys., 120 (9): 4247--4250 (2004)A systematic study of the (x)over-tilde b-2(1), (a)over-bar (2)a(1), and (b)over-bar b-2(2) states of the neutral radical ph2H. Woodcock, S. Wesolowski, Y. Yamaguchi, and H. Schaefer. J. Phys. Chem. A, 105 (20): 5037--5045 (2001)Exploring the quantum mechanical/molecular mechanical replica path method: a pathway optimization of the chorismate to prephenate claisen rearrangement catalyzed by chorismate mutaseH. Woodcock, M. Hodoscek, P. Sherwood, Y. Lee, H. Schaefer, and B. Brooks. Theor. Chem. Acc., 109 (3): 140--148 (2003)CHARMM: The biomolecular simulation programB. Brooks, C. III, A. Jr, L. Nilsson, R. Petrella, B. Roux, Y. Won, G. Archontis, C. Bartels, S. Boresch and 25 other author(s). J. Comput. Chem., 30 (10): 1545--1614 (2009)Problematic energy differences between cumulenes and poly-ynes: does this point to a systematic improvement of density functional theory?H. Woodcock, H. Schaefer, and P. Schreiner. J. Phys. Chem. A, 106 (49): 11923--11931 (2002)

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Disambiguation of "Woodcock, H. L."

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CHARMM: The biomolecular simulation program

Please choose a person to relate this publication to

Dumitru H l l u

Dan Woodcock

Amanda L H Tufman

Steven H L Verhelst

Jens H L Neumann

Other publications of authors with the same name

Disambiguation

BibSonomy

Disambiguation of "Woodcock, H. L."

copydeleteadd this publication to your clipboardcommunity posthistory of this postURLDOIBibTeXEndNoteAPAChicagoDIN 1505HarvardMSOffice XML CHARMM: The biomolecular simulation program

Please choose a person to relate this publication to

Dumitru H l l u

Dan Woodcock

Amanda L H Tufman

Steven H L Verhelst

Jens H L Neumann

Other publications of authors with the same name

Disambiguation

copy delete add this publication to your clipboard
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history of this post
URL
DOI
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Chicago
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CHARMM: The biomolecular simulation program