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Application

Discovery Studio 0.8860634894594372 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06824175824175824 Amorphous Cell 0.2834065934065934 Blends 0.0026373626373626374 CASTEP 0.3989010989010989 CDOCKER 0.15615384615384614 CHARMm 0.24175824175824176 COMPASS 0.37274725274725273 COMPASS III 0.08516483516483517 COSMObase 0.0037362637362637363 COSMOconf 0.003956043956043956 COSMOmic 2.1978021978021978E-4 COSMOperm 0.001098901098901099 COSMOplex 2.1978021978021978E-4 COSMOquick 0.0014285714285714286 COSMOtherm 0.06472527472527473 Cantera 0.0 Catalyst 0.10065934065934067 Classical Simulations 1.0 Conformers 0.001098901098901099 Crystallization 0.0754945054945055 DFTB Plus 0.005054945054945055 DMol3 0.18582417582417582 DPD 0.0025274725274725277 Discover 0.004285714285714286 Forcite 0.5415384615384615 GULP 0.027032967032967033 Kinetix 2.1978021978021978E-4 LUDI 0.004615384615384616 LibDock 0.06626373626373626 LigandFit 0.005384615384615384 MCSS 9.89010989010989E-4 MODELER 0.18527472527472527 MesoDyn 0.0015384615384615385 Mesocite 0.003956043956043956 Mesoscale 0.007252747252747253 Modules 0.0 Morphology 0.017252747252747253 ONETEP 8.791208791208791E-4 Polymorph 0.0018681318681318681 QMERA 2.1978021978021978E-4 QSAR 0.001098901098901099 Quantum Mechanics 0.5723076923076923 Reflex 0.055714285714285716 Reflex Plus 7.692307692307692E-4 Semi-empirical 0.007142857142857143 Sorption 0.057692307692307696 Synthia 0.0015384615384615385 TURBOMOLE 5.494505494505495E-4 VAMP 0.0016483516483516484 Visualization 0.7586813186813187 X-Cell 0.0014285714285714286 ZDOCK 0.026703296703296703

Year

2020 0.0 2021 0.038608354237103286 2022 0.18300796160977206 2023 0.2556440178863562 2024 0.7648598538553822 2025 1.0 2026 0.4641727560257389 2027 0.0010906314756243866

Keywords

target 1.0 potential 0.2688805305354845 docking 0.19904978719192318 analysis 0.18435118281698507 visualization 0.18331188755815103 between 0.15693358408393546 novel 0.0970998713253489 energy 0.09338810254379887 cell 0.06260516678214392 binding 0.061763832524992575 promising 0.05701276848460853 activity 0.04117588834999505 performance 0.03657329506087301 stability 0.034890626546570325 interaction 0.03365337028605365 experimental 0.03241611402553697 synthesized 0.025388498465802236 mechanism 0.020142531921211522 effective 0.019944570919528854 development 0.01727209739681283 including 0.013857270117786796 protein 0.009353657329506087 synthesis 0.0063842423042660594 design 0.004503612788280709 chemical 0.0
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