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Application

Discovery Studio 1.0 Materials Studio 0.6572779605263158 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06702898550724638 Amorphous Cell 0.23623188405797102 Blends 0.002536231884057971 CASTEP 0.3373188405797101 CDOCKER 0.21594202898550724 CHARMm 0.3463768115942029 COMPASS 0.35833333333333334 COMPASS III 0.04021739130434782 COSMObase 0.0010869565217391304 COSMOconf 3.6231884057971015E-4 COSMOmic 0.0 COSMOperm 7.246376811594203E-4 COSMOquick 3.6231884057971015E-4 COSMOtherm 0.04673913043478261 Catalyst 0.14565217391304347 Classical Simulations 1.0 Conformers 7.246376811594203E-4 Crystallization 0.07355072463768116 DFTB Plus 0.006159420289855073 DMol3 0.17028985507246377 DPD 0.003260869565217391 Discover 0.002898550724637681 Forcite 0.46195652173913043 GULP 0.028985507246376812 Kinetix 0.0 LUDI 0.0036231884057971015 LibDock 0.09202898550724638 LigandFit 0.006521739130434782 MCSS 0.0010869565217391304 MODELER 0.32717391304347826 MesoDyn 0.002536231884057971 Mesocite 0.004710144927536232 Mesoscale 0.009057971014492754 Morphology 0.016304347826086956 ONETEP 3.6231884057971015E-4 Polymorph 7.246376811594203E-4 QMERA 3.6231884057971015E-4 QSAR 7.246376811594203E-4 Quantum Mechanics 0.4996376811594203 Reflex 0.05615942028985507 Semi-empirical 0.009057971014492754 Sorption 0.04057971014492753 Synthia 0.0018115942028985507 TURBOMOLE 7.246376811594203E-4 VAMP 0.0018115942028985507 Visualization 0.9945652173913043 X-Cell 3.6231884057971015E-4 ZDOCK 0.036231884057971016

Year

2024 0.0

Keywords

target 1.0 potential 0.30891765040534774 docking 0.27933437633338076 visualization 0.216612146209643 analysis 0.20338500924477315 between 0.13767600625800028 novel 0.10368368653107667 binding 0.09301664059166548 activity 0.06883800312900014 protein 0.04380600199118191 interaction 0.04167259280329967 promising 0.03840136538188024 energy 0.03498791068126867 cell 0.028303228559237663 synthesized 0.01664059166548144 stability 0.014933864315175651 synthesis 0.013227136964869862 effective 0.012373773289716969 development 0.009955909543450435 including 0.009244773147489688 mechanism 0.008391409472336794 vitro 0.005404636609301664 silico 0.0044090456549566205 compound 0.0011378182335371925 experimental 0.0
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