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Application

Discovery Studio 1.0 Materials Studio 0.9622672508214677 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06755832510069154 Amorphous Cell 0.27509689186108366 Blends 0.0028117638118398056 CASTEP 0.4128733186412341 CDOCKER 0.17995288395774756 CHARMm 0.2629379132152899 COMPASS 0.3710768295463181 COMPASS III 0.07378980165666084 COSMObase 0.0028877574283760164 COSMOconf 0.003343719127593282 COSMOmic 2.2798084960863287E-4 COSMOperm 0.0012918914811155863 COSMOplex 3.0397446614484385E-4 COSMOquick 0.001519872330724219 COSMOtherm 0.06292271449198267 Cantera 7.599361653621096E-5 Catalyst 0.12531347366821188 Classical Simulations 1.0 Conformers 9.879170149707424E-4 Crystallization 0.07553765483699369 DFTB Plus 0.005927502089824455 DMol3 0.18945208602477392 DPD 0.0031917318945208603 Discover 0.004559616992172657 Forcite 0.5292195455581731 GULP 0.026445778554601413 Kinetix 2.2798084960863287E-4 LUDI 0.005927502089824455 LibDock 0.07264989740861767 LigandFit 0.008131316969374573 MCSS 0.0014438787141880082 MODELER 0.1942396838665552 MesoDyn 0.0015958659472604302 Mesocite 0.004331636142564025 Mesoscale 0.007903336119765939 Modules 0.0 Morphology 0.017250550953719888 ONETEP 0.0012158978645793754 Polymorph 0.0018998404134052739 QMERA 2.2798084960863287E-4 QSAR 0.0014438787141880082 Quantum Mechanics 0.5900904324036781 Reflex 0.056007295387187475 Reflex Plus 6.839425488258987E-4 Semi-empirical 0.007979329736302151 Sorption 0.05425944220685462 Synthia 0.0014438787141880082 TURBOMOLE 5.319553157534767E-4 VAMP 0.001671859563796641 Visualization 0.8974846112926514 X-Cell 0.0012158978645793754 ZDOCK 0.031081389163310283

Year

2020 0.004855195911413969 2021 0.22385008517887564 2022 0.29378194207836456 2023 0.4045996592844974 2024 1.0 2025 0.974190800681431 2026 0.3620954003407155 2027 0.0

Keywords

target 1.0 potential 0.26162292532766335 docking 0.2169401161499159 visualization 0.21465519977150838 analysis 0.17720795912538478 between 0.14994763733299482 novel 0.09986988670622957 energy 0.07927390435086161 binding 0.0692139252959284 cell 0.0557265716733839 activity 0.051886642759671225 promising 0.0429691218939418 interaction 0.03884357843292818 synthesized 0.027323791691790167 experimental 0.02630827330138682 stability 0.02472152581638158 protein 0.01942178921646409 mechanism 0.016026149598552888 development 0.015423185554250896 effective 0.015232775856050268 performance 0.012789184729142204 synthesis 0.012313160483640633 including 0.006664339437021992 chemical 0.001999301831106598 design 0.0
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