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Application

Discovery Studio 1.0 Materials Studio 0.9546745082133441 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06267806267806268 Amorphous Cell 0.2757834757834758 Blends 0.002564102564102564 CASTEP 0.41752136752136754 CDOCKER 0.18304843304843305 CHARMm 0.25769230769230766 COMPASS 0.3747863247863248 COMPASS III 0.07564102564102564 COSMObase 0.0029914529914529917 COSMOconf 0.0035612535612535613 COSMOmic 1.4245014245014244E-4 COSMOperm 0.001282051282051282 COSMOplex 4.2735042735042735E-4 COSMOquick 0.0011396011396011395 COSMOtherm 0.06766381766381767 Cantera 0.0 Catalyst 0.12207977207977208 Classical Simulations 1.0 Conformers 0.0011396011396011395 Crystallization 0.07578347578347579 DFTB Plus 0.007834757834757835 DMol3 0.1943019943019943 DPD 0.002849002849002849 Discover 0.004558404558404558 Forcite 0.5296296296296297 GULP 0.028205128205128206 Kinetix 2.849002849002849E-4 LUDI 0.005413105413105413 LibDock 0.07364672364672364 LigandFit 0.00811965811965812 MCSS 0.001282051282051282 MODELER 0.20056980056980056 MesoDyn 0.0017094017094017094 Mesocite 0.003703703703703704 Mesoscale 0.007407407407407408 Modules 0.0 Morphology 0.018518518518518517 ONETEP 8.547008547008547E-4 Polymorph 0.002279202279202279 QMERA 1.4245014245014244E-4 QSAR 0.0015669515669515669 Quantum Mechanics 0.5991452991452991 Reflex 0.05455840455840456 Reflex Plus 8.547008547008547E-4 Semi-empirical 0.009971509971509971 Sorption 0.05683760683760684 Synthia 0.002136752136752137 TURBOMOLE 4.2735042735042735E-4 VAMP 0.0017094017094017094 Visualization 0.9232193732193732 X-Cell 7.122507122507123E-4 ZDOCK 0.03076923076923077

Year

2020 0.0929136509005218 2021 0.25820568927789933 2022 0.292711664702912 2023 0.5108567581215283 2024 1.0 2025 0.9654940245749873 2026 0.3593671099141559 2027 0.0

Keywords

target 1.0 potential 0.25656778421391374 visualization 0.21982329881224036 docking 0.216020127552513 analysis 0.17441928500380316 between 0.14920133403545727 novel 0.09940904569656545 energy 0.08091978234158329 binding 0.06687730384412849 cell 0.05570183137323738 activity 0.05412205254227371 promising 0.04043063600725528 interaction 0.03849979521385524 synthesized 0.03101047334854602 experimental 0.028611549938564157 protein 0.020712655783745832 stability 0.01995202153180036 development 0.016733953542800304 mechanism 0.01579778830963665 synthesis 0.012872271956000233 effective 0.011819086068691123 performance 0.010356327891872916 including 0.005382950090691007 chemical 0.00280849569949096 design 0.0
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