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Application

Discovery Studio 1.0 Materials Studio 0.9855479395490957 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06572820790471035 Amorphous Cell 0.278938819707634 Blends 0.002273957769355712 CASTEP 0.3792095289658906 CDOCKER 0.1726042230644288 CHARMm 0.26486193827828913 COMPASS 0.3565782349756362 COMPASS III 0.08391987005955603 COSMObase 0.0033567948023822416 COSMOconf 0.003898213318895506 COSMOmic 3.2485110990795884E-4 COSMOperm 9.745533297238765E-4 COSMOplex 2.165674066053059E-4 COSMOquick 0.0015159718462371414 COSMOtherm 0.06269626421223606 Cantera 0.0 Catalyst 0.11802923659989172 Classical Simulations 1.0 Conformers 0.0010828370330265296 Crystallization 0.07363291824580401 DFTB Plus 0.004547915538711424 DMol3 0.170979967514889 DPD 0.0025988088792636707 Discover 0.0035733622089875474 Forcite 0.5323226854358419 GULP 0.022956145100162424 Kinetix 2.165674066053059E-4 LUDI 0.004981050351922036 LibDock 0.07103410936654034 LigandFit 0.006063887384948566 MCSS 8.662696264212236E-4 MODELER 0.20216567406605307 MesoDyn 0.0011911207363291825 Mesocite 0.0033567948023822416 Mesoscale 0.006497022198159177 Modules 0.0 Morphology 0.017108825121819167 ONETEP 0.0010828370330265296 Polymorph 0.0017325392528424472 QMERA 2.165674066053059E-4 QSAR 7.579859231185707E-4 Quantum Mechanics 0.539469409853817 Reflex 0.05425013535462913 Reflex Plus 8.662696264212236E-4 Semi-empirical 0.0062804547915538715 Sorption 0.055549539794260964 Synthia 7.579859231185707E-4 TURBOMOLE 5.414185165132648E-4 VAMP 0.0012994044396318354 Visualization 0.8217650243638333 X-Cell 0.0012994044396318354 ZDOCK 0.028695181375203032

Year

2021 0.0033620092949668743 2022 0.14792840897854248 2023 0.26569761692870564 2024 0.7118560268960744 2025 1.0 2026 0.4202511618708593 2027 0.0

Keywords

target 1.0 potential 0.2839880585698716 docking 0.2236174951428707 visualization 0.20276737904563333 analysis 0.1973179168838554 between 0.15429085911955645 novel 0.105577406056011 energy 0.08652798180353505 binding 0.0772875894422594 cell 0.06454058664644838 promising 0.0625977349192058 activity 0.056105766952565986 stability 0.039283514192294935 interaction 0.03577690375775956 synthesized 0.031133014263374875 performance 0.030706534615931383 experimental 0.02757901720134578 effective 0.022887741079467373 mechanism 0.022887741079467373 development 0.02013931668483154 protein 0.02009193005733782 including 0.019902383547362935 synthesis 0.014026441738141496 design 0.004027863336966308 chemical 0.0
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