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Application

Discovery Studio 1.0 Materials Studio 0.2672466113696136 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.029788838612368026 Amorphous Cell 0.10067873303167421 Blends 0.0015082956259426848 CASTEP 0.13536953242835595 CDOCKER 0.2239819004524887 CHARMm 0.3597285067873303 COMPASS 0.15874811463046756 COMPASS III 0.01583710407239819 COSMObase 3.770739064856712E-4 COSMOconf 0.0 COSMOperm 3.770739064856712E-4 COSMOquick 0.0 COSMOtherm 0.016968325791855202 Catalyst 0.15120663650075414 Classical Simulations 0.6489441930618401 Conformers 3.770739064856712E-4 Crystallization 0.032805429864253395 DFTB Plus 0.0030165912518853697 DMol3 0.06221719457013575 DPD 7.541478129713424E-4 Forcite 0.2002262443438914 GULP 0.01282051282051282 Kinetix 0.0 LUDI 0.003770739064856712 LibDock 0.09577677224736049 LigandFit 0.006787330316742082 MCSS 0.0011312217194570137 MODELER 0.3404977375565611 MesoDyn 0.0011312217194570137 Mesocite 0.0015082956259426848 Mesoscale 0.003770739064856712 Morphology 0.007918552036199095 ONETEP 0.0 Polymorph 3.770739064856712E-4 Quantum Mechanics 0.19607843137254902 Reflex 0.023755656108597284 Semi-empirical 0.004147812971342383 Sorption 0.021493212669683258 Synthia 7.541478129713424E-4 TURBOMOLE 7.541478129713424E-4 VAMP 7.541478129713424E-4 Visualization 1.0 X-Cell 0.0 ZDOCK 0.03770739064856712

Year

2024 0.0

Keywords

target 1.0 docking 0.41711332312404287 potential 0.36887442572741197 visualization 0.3169984686064318 analysis 0.24042879019908117 binding 0.15658499234303216 novel 0.1276799387442573 activity 0.11753445635528331 between 0.10394333843797857 protein 0.09820061255742726 promising 0.051875957120980094 vitro 0.04862174578866769 silico 0.04728177641653905 interaction 0.04153905053598775 drug 0.03330781010719755 synthesis 0.02986217457886677 compound 0.027947932618683002 treatment 0.018950995405819297 therapeutic 0.01799387442572741 synthesized 0.01569678407350689 inhibition 0.014165390505359877 development 0.012442572741194487 including 0.004594180704441042 effective 0.0036370597243491577 stability 0.0
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