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Application

Discovery Studio 1.0 Materials Studio 0.8160639777468707 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06109979633401222 Amorphous Cell 0.18228105906313646 Blends 0.003054989816700611 CASTEP 0.4429735234215886 CDOCKER 0.20213849287169042 CHARMm 0.2454175152749491 COMPASS 0.3065173116089613 COMPASS III 0.010183299389002037 COSMObase 5.091649694501018E-4 COSMOconf 0.0 COSMOmic 0.0 COSMOperm 0.0010183299389002036 COSMOplex 0.0 COSMOquick 5.091649694501018E-4 COSMOtherm 0.07026476578411406 Catalyst 0.16395112016293278 Classical Simulations 0.8065173116089613 Conformers 0.0010183299389002036 Crystallization 0.07077393075356415 DFTB Plus 0.006619144602851324 DMol3 0.2209775967413442 DPD 0.006619144602851324 Discover 0.01680244399185336 Forcite 0.34572301425661917 GULP 0.034623217922606926 LUDI 0.006619144602851324 LibDock 0.07942973523421588 LigandFit 0.010183299389002037 MCSS 0.0015274949083503055 MODELER 0.0814663951120163 MesoDyn 0.003054989816700611 Mesocite 0.007637474541751527 Mesoscale 0.015784114052953158 Morphology 0.017820773930753563 ONETEP 0.0025458248472505093 Polymorph 0.003054989816700611 QMERA 5.091649694501018E-4 QSAR 0.0025458248472505093 Quantum Mechanics 0.6542769857433809 Reflex 0.04989816700610998 Reflex Plus 0.0015274949083503055 Semi-empirical 0.01120162932790224 Sorption 0.032586558044806514 Synthia 5.091649694501018E-4 TURBOMOLE 0.0010183299389002036 VAMP 0.003054989816700611 Visualization 1.0 X-Cell 0.0 ZDOCK 0.04073319755600815

Year

2022 0.0

Keywords

target 1.0 visualization 0.26145833333333335 docking 0.2225 potential 0.18875 between 0.14 analysis 0.12666666666666668 novel 0.085 binding 0.06979166666666667 activity 0.06520833333333333 energy 0.05875 interaction 0.04770833333333333 experimental 0.04666666666666667 cell 0.033541666666666664 synthesized 0.032916666666666664 protein 0.029791666666666668 synthesis 0.02666666666666667 well 0.025625 chemical 0.0225 mechanism 0.01875 compound 0.009791666666666667 drug 0.007291666666666667 design 0.004791666666666666 vitro 0.0014583333333333334 promising 2.0833333333333335E-4 inhibition 0.0
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