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Application

Discovery Studio 0.890551445864156 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06824029533504866 Amorphous Cell 0.2877279337733527 Blends 0.0022373867322966774 CASTEP 0.3926613715180669 CDOCKER 0.1554983778946191 CHARMm 0.241078420404967 COMPASS 0.3695044188387963 COMPASS III 0.08669873587649625 COSMObase 0.003356080098445016 COSMOconf 0.0045866428012081885 COSMOmic 2.2373867322966775E-4 COSMOperm 0.0011186933661483387 COSMOplex 3.356080098445016E-4 COSMOquick 0.0012305627027631727 COSMOtherm 0.06566730059290748 Cantera 0.0 Catalyst 0.105716523101018 Classical Simulations 1.0 Conformers 5.593466830741693E-4 Crystallization 0.07495245553193869 DFTB Plus 0.006040944177201029 DMol3 0.176417943841593 DPD 0.0030204720886005147 Discover 0.0038035574449043516 Forcite 0.5484953574225305 GULP 0.023156952679270613 Kinetix 2.2373867322966775E-4 LUDI 0.0038035574449043516 LibDock 0.06555543125629265 LigandFit 0.004922250811052691 MCSS 4.474773464593355E-4 MODELER 0.1901778722452176 MesoDyn 0.001006824029533505 Mesocite 0.003579818771674684 Mesoscale 0.006712160196890032 Modules 0.0 Morphology 0.01767535518514375 ONETEP 0.0011186933661483387 Polymorph 0.00201364805906701 QMERA 2.2373867322966775E-4 QSAR 0.001006824029533505 Quantum Mechanics 0.5587873363910952 Reflex 0.054592236268038934 Reflex Plus 8.94954692918671E-4 Semi-empirical 0.007830853563038372 Sorption 0.056382145653876274 Synthia 0.0012305627027631727 TURBOMOLE 4.474773464593355E-4 VAMP 0.0013424320393780065 Visualization 0.7536637207741358 X-Cell 0.0013424320393780065 ZDOCK 0.02796733415370847

Year

2022 0.09916451163715934 2023 0.21374577282673562 2024 0.6768450368012732 2025 1.0 2026 0.42261786353690073 2027 0.0

Keywords

target 1.0 potential 0.275385701320964 docking 0.19975799132802258 analysis 0.19219522032872843 visualization 0.1808006453564586 between 0.1586669355651911 novel 0.0971563981042654 energy 0.09403045275789049 cell 0.06791368357366138 binding 0.06569527074720177 promising 0.0631743470807704 activity 0.04699001714228093 stability 0.041443985076131895 performance 0.03836845820308561 experimental 0.031057779570434606 interaction 0.030452757890491077 synthesized 0.02742764949077342 mechanism 0.022234546737924774 effective 0.021881617424624383 including 0.01875567207824947 development 0.017192699405062014 synthesis 0.008167792679237673 protein 0.007814863365937279 design 0.0034284561863466775 enhanced 0.0
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