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Application

Discovery Studio 0.6745014245014245 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.08590852904820766 Amorphous Cell 0.10754017305315204 Antibody 0.0 Blends 0.0030902348578491965 CASTEP 0.6372064276885043 CDOCKER 0.25401730531520395 CHARMm 0.2812113720642769 COMPASS 0.2836835599505562 COMPASS III 0.006180469715698393 COSMOconf 6.180469715698393E-4 COSMOtherm 0.032756489493201486 Catalyst 0.31396786155747836 Classical Simulations 0.8887515451174289 Conformers 0.0012360939431396785 Crystallization 0.1631644004944376 DFTB Plus 0.004944375772558714 DMol3 0.37762669962917184 DPD 0.007416563658838072 Discover 0.03522867737948084 Equilibria 0.0 Forcite 0.33559950556242274 GULP 0.0377008652657602 LUDI 0.009270704573547589 LibDock 0.04511742892459827 LigandFit 0.04511742892459827 MCSS 0.0012360939431396785 MODELER 0.17490729295426452 MesoDyn 0.004326328800988875 Mesocite 0.004326328800988875 Mesoscale 0.014833127317676144 Morphology 0.01668726823238566 ONETEP 0.0 Polymorph 0.007416563658838072 QMERA 0.0012360939431396785 QSAR 0.0030902348578491965 Quantum Mechanics 1.0 Reflex 0.12978986402966625 Reflex Plus 0.013597033374536464 Semi-empirical 0.019777503090234856 Sorption 0.04758961681087762 Synthia 0.0012360939431396785 TURBOMOLE 6.180469715698393E-4 VAMP 0.012360939431396786 Visualization 0.5735475896168108 X-Cell 0.005562422744128554 ZDOCK 0.008034610630407911

Year

2003 0.0 2004 0.022321428571428572 2005 0.023809523809523808 2006 0.046130952380952384 2007 0.052083333333333336 2008 0.08779761904761904 2009 0.13690476190476192 2010 0.15327380952380953 2011 0.17857142857142858 2012 0.23660714285714285 2013 0.4270833333333333 2014 0.5014880952380952 2015 0.5461309523809523 2016 0.5431547619047619 2017 0.4880952380952381 2018 0.5238095238095238 2019 0.40773809523809523 2020 0.49107142857142855 2021 0.3020833333333333 2022 1.0 2023 0.6666666666666666 2024 0.23363095238095238 2025 0.08333333333333333 2026 0.050595238095238096

Keywords

synthesized 1.0 target 0.9705112960760999 synthesis 0.289179548156956 novel 0.20023781212841854 compound 0.13269916765755055 docking 0.12556480380499405 potential 0.1065398335315101 between 0.10083234244946493 activity 0.07372175980975029 designed 0.06801426872770511 visualization 0.06634958382877527 analysis 0.059215219976218786 experimental 0.04970273483947681 design 0.04875148632580262 potent 0.03186682520808561 well 0.02568370986920333 x-ray 0.024494649227110584 energy 0.022829964328180737 chemical 0.017598097502972653 medicinal 0.016409036860879904 binding 0.013555291319857313 inhibition 0.013079667063020214 promising 0.012604042806183116 cell 0.002140309155766944 catalyst 0.0
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