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Application

Discovery Studio 0.9709762532981531 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05931434790495193 Amorphous Cell 0.28713948848177034 Blends 0.0021766733176129148 CASTEP 0.33865409033194266 CDOCKER 0.16343188826410304 CHARMm 0.26247052421549066 COMPASS 0.3430074369671685 COMPASS III 0.10448031924541992 COSMObase 0.004716125521494649 COSMOconf 0.005804462180301106 COSMOmic 0.0 COSMOperm 3.6277888626881915E-4 COSMOplex 1.8138944313440957E-4 COSMOquick 0.0014511155450752766 COSMOtherm 0.06566297841465626 Catalyst 0.0812624705242155 Classical Simulations 1.0 Conformers 3.6277888626881915E-4 Crystallization 0.07128605115182296 DFTB Plus 0.003809178305822601 DMol3 0.15599492109559224 DPD 0.0019952838744785053 Discover 0.003809178305822601 Forcite 0.5309269000544168 GULP 0.019952838744785054 Kinetix 1.8138944313440957E-4 LUDI 0.0036277888626881916 LibDock 0.06856520950480682 LigandFit 0.0039905677489570105 MCSS 3.6277888626881915E-4 MODELER 0.2481407582078723 MesoDyn 5.441683294032287E-4 Mesocite 0.0027208416470161437 Mesoscale 0.005078904407763468 Modules 0.0 Morphology 0.016687828768365682 ONETEP 9.069472156720479E-4 Polymorph 0.0021766733176129148 QMERA 1.8138944313440957E-4 QSAR 7.255577725376383E-4 Quantum Mechanics 0.4846725920551424 Reflex 0.05151460185017232 Reflex Plus 7.255577725376383E-4 Semi-empirical 0.005441683294032287 Sorption 0.057500453473607833 Synthia 0.0010883366588064574 TURBOMOLE 1.8138944313440957E-4 VAMP 0.0010883366588064574 Visualization 0.70506076546345 X-Cell 0.0014511155450752766 ZDOCK 0.028296753128967893

Year

2023 1.4409221902017292E-4 2024 0.4847262247838617 2025 1.0 2026 0.6097982708933718 2027 0.0

Keywords

target 1.0 potential 0.30124142720722286 docking 0.21416789651879503 analysis 0.21251844778192552 visualization 0.16407674277281015 between 0.14888445177532772 novel 0.096536157652574 promising 0.08108342738084903 energy 0.08090980119802066 binding 0.06858234221720635 cell 0.06467575310356802 activity 0.04687906936366004 performance 0.04036808750759614 stability 0.03880545186214081 including 0.020574702665161905 experimental 0.017275805191422865 synthesized 0.017102179008594495 development 0.016407674277281015 effective 0.01571316954596753 mechanism 0.014324160083340568 interaction 0.010330757878288046 enhanced 0.009809879329802934 strong 0.004687906936366004 protein 6.076916398992968E-4 design 0.0
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