Zain, S.M.

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	Issue Date	Title	Author(s)
1	2011	Validation of quantitative structure-activity relationship (QSAR) model for photosensitizer activity prediction	Frimayanti, N. ; Yam, M.L. ; Lee, H.B. ; Othman, R. ; Zain, S.M. ; Rahman, N.A.
2	2012	Transition state study of cyclization step in peptide catalyzed flavanone synthesis	Lee, V.S. ; Lee, Y.K. ; Frimayanti, N. ; Zain, S.M. ; Wahab, H.A. ; Rahman, N.A.
3	2016	QSAR, in silico docking and in vitro evaluation of chalcone derivatives as potential inhibitors for H1N1 virus neuraminidase	Yaeghoobi, M. ; Frimayanti, N. ; Chee, C.F. ; Ikram, K.K. ; Najjar, B.O. ; Zain, S.M. ; Abdullah, Z. ; Wahab, H.A. ; Rahman, N.A.
4	2008	Pheophorbide b ethyl ester from a chlorella vulgaris dietary supplement	Chee, C.F. ; Rahman, N.A. ; Zain, S.M. ; Ng, S.W.
5	2013	Improved SCFV ANTI-HIV-1 P17 binding affinity guided from the theoretical calculation of pairwise decomposition energies and Computational Alanine Scanning	Tue-Ngeun, P. ; Kodchakorn, K. ; Nimmanpipug, P. ; Lawan, N. ; Nangola, S. ; Tayapiwatana, C. ; Rahman, N.A. ; Zain, S.M. ; Lee, V.S.
6	2014	GPU accelerated molecular dynamics simulations for protein-protein interaction of ankyrin complex	Kodchakorn, K. ; Dokmaisrijan, S. ; Chong, W.L. ; Payaka, A. ; Wisitponchai, T. ; Nimmanpipug, P. ; Zain, S.M. ; Rahman, N.A. ; Tayapiwatana, C. ; Lee, V.S.
7	2009	Generating qualitative causal graph using modeling constructs of qualitative process theory for explaining organic chemistry reactions	Tang, A.Y.C. ; Abdullah, R. ; Zain, S.M. ; Rahman, N.A.
8	2011	Fragment-based molecular design of new competitive Dengue Den2 Ns2b/Ns3 inhibitors from the components of fingerroot (Boesenbergia rotunda)	Frimayanti, N. ; Zain, S.M. ; Lee, V.S. ; Wahab, H.A. ; Yusof, R. ; Rahman, N.A.
9	2008	Embedding explanation facility in chemistry educational software: Towards the Qualitative Reasoning approach	Tang, A.Y.C. ; Zain, S.M. ; Rahman, N.A. ; Abdullah, R.
10	2010	Discovering new competivive dengue DEN2 NS2B/NS3 inhibitors using similarity searching	Frimayanti, N. ; Zain, S.M. ; Rahman, N.A.
11	2011	Design of new competitive dengue Ns2b/Ns3 protease inhibitors-a computational approach	Frimayanti, N. ; Chee, C.F. ; Zain, S.M. ; Rahman, N.A.
12	2009	Deriving causal explanation from qualitative model reasoning	Tang, A.Y.C. ; Zain, S.M. ; Rahman, N.A. ; Abdullah, R.
13	2007	An ontology-based reasoning framework for reaction mechanisms simulation	Tang, Y.C.A. ; Zain, S.M. ; Rahman, N.A. ; Abdullah, R.
14	2010	An ONIOM study on the enantioselective Diels-Alder reaction catalyzed by SiO2 - Immobilized chiral oxazaborolidinium cation	Omar, N.Y.M. ; Rahman, N.A. ; Zain, S.M.
15	2001	An insight to the cleavage of β-carotene to vitamin A: A molecular mechanics study	Mohamed, N. ; Hashim, R. ; Rahman, N.A. ; Zain, S.M.
16	1998	A structural study of the interaction of dibenzyldiaza-18-crown-6 with neodymium(III) nitrate hexahydrate	Saleh, M.I. ; Salhin, A. ; Saad, B. ; Zain, S.M. ; Rahman, N.A. ; Arifin, Z.

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